Details of the Target

General Information of Target

Target ID LDTP05591
Target Name Nuclear cap-binding protein subunit 1 (NCBP1)
Gene Name NCBP1
Gene ID 4686
Synonyms
CBP80; NCBP; Nuclear cap-binding protein subunit 1; 80 kDa nuclear cap-binding protein; CBP80; NCBP 80 kDa subunit
3D Structure
Download
2D Sequence (FASTA)
Download
3D Structure (PDB)
Download
Sequence
MSRRRHSDENDGGQPHKRRKTSDANETEDHLESLICKVGEKSACSLESNLEGLAGVLEAD
LPNYKSKILRLLCTVARLLPEKLTIYTTLVGLLNARNYNFGGEFVEAMIRQLKESLKANN
YNEAVYLVRFLSDLVNCHVIAAPSMVAMFENFVSVTQEEDVPQVRRDWYVYAFLSSLPWV
GKELYEKKDAEMDRIFANTESYLKRRQKTHVPMLQVWTADKPHPQEEYLDCLWAQIQKLK
KDRWQERHILRPYLAFDSILCEALQHNLPPFTPPPHTEDSVYPMPRVIFRMFDYTDDPEG
PVMPGSHSVERFVIEENLHCIIKSHWKERKTCAAQLVSYPGKNKIPLNYHIVEVIFAELF
QLPAPPHIDVMYTTLLIELCKLQPGSLPQVLAQATEMLYMRLDTMNTTCVDRFINWFSHH
LSNFQFRWSWEDWSDCLSQDPESPKPKFVREVLEKCMRLSYHQRILDIVPPTFSALCPAN
PTCIYKYGDESSNSLPGHSVALCLAVAFKSKATNDEIFSILKDVPNPNQDDDDDEGFSFN
PLKIEVFVQTLLHLAAKSFSHSFSALAKFHEVFKTLAESDEGKLHVLRVMFEVWRNHPQM
IAVLVDKMIRTQIVDCAAVANWIFSSELSRDFTRLFVWEILHSTIRKMNKHVLKIQKELE
EAKEKLARQHKRRSDDDDRSSDRKDGVLEEQIERLQEKVESAQSEQKNLFLVIFQRFIMI
LTEHLVRCETDGTSVLTPWYKNCIERLQQIFLQHHQIIQQYMVTLENLLFTAELDPHILA
VFQQFCALQA
Target Bioclass
Transporter and channel
Family
NCBP1 family
Subcellular location
Nucleus
Function
Component of the cap-binding complex (CBC), which binds cotranscriptionally to the 5'-cap of pre-mRNAs and is involved in various processes such as pre-mRNA splicing, translation regulation, nonsense-mediated mRNA decay, RNA-mediated gene silencing (RNAi) by microRNAs (miRNAs) and mRNA export. The CBC complex is involved in mRNA export from the nucleus via its interaction with ALYREF/THOC4/ALY, leading to the recruitment of the mRNA export machinery to the 5'-end of mRNA and to mRNA export in a 5' to 3' direction through the nuclear pore. The CBC complex is also involved in mediating U snRNA and intronless mRNAs export from the nucleus. The CBC complex is essential for a pioneer round of mRNA translation, before steady state translation when the CBC complex is replaced by cytoplasmic cap-binding protein eIF4E. The pioneer round of mRNA translation mediated by the CBC complex plays a central role in nonsense-mediated mRNA decay (NMD), NMD only taking place in mRNAs bound to the CBC complex, but not on eIF4E-bound mRNAs. The CBC complex enhances NMD in mRNAs containing at least one exon-junction complex (EJC) via its interaction with UPF1, promoting the interaction between UPF1 and UPF2. The CBC complex is also involved in 'failsafe' NMD, which is independent of the EJC complex, while it does not participate in Staufen-mediated mRNA decay (SMD). During cell proliferation, the CBC complex is also involved in microRNAs (miRNAs) biogenesis via its interaction with SRRT/ARS2 and is required for miRNA-mediated RNA interference. The CBC complex also acts as a negative regulator of PARN, thereby acting as an inhibitor of mRNA deadenylation. In the CBC complex, NCBP1/CBP80 does not bind directly capped RNAs (m7GpppG-capped RNA) but is required to stabilize the movement of the N-terminal loop of NCBP2/CBP20 and lock the CBC into a high affinity cap-binding state with the cap structure. Associates with NCBP3 to form an alternative cap-binding complex (CBC) which plays a key role in mRNA export and is particularly important in cellular stress situations such as virus infections. The conventional CBC with NCBP2 binds both small nuclear RNA (snRNA) and messenger (mRNA) and is involved in their export from the nucleus whereas the alternative CBC with NCBP3 does not bind snRNA and associates only with mRNA thereby playing a role only in mRNA export. NCBP1/CBP80 is required for cell growth and viability.
Uniprot ID
Q09161
Ensemble ID
ENST00000375147.8
HGNC ID
HGNC:7658
ChEMBL ID
CHEMBL4665589

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 34 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		11.18  LDD0402  [1]
CY-1
 Probe Info  		100.00  LDD0243  [2]
TH211
 Probe Info  		Y294(20.00); Y98(12.60)  LDD0257  [3]
TH216
 Probe Info  		Y64(5.82)  LDD0259  [3]
Probe 1
 Probe Info  		Y121(36.46); Y126(30.54); Y294(10.27)  LDD3495  [4]
BTD
 Probe Info  		C73(2.02); C332(1.26)  LDD1700  [5]
Jackson_1
 Probe Info  		2.78  LDD0120  [6]
AHL-Pu-1
 Probe Info  		C503(2.36)  LDD0168  [7]
HHS-475
 Probe Info  		Y64(0.81); Y294(1.40); Y461(1.41)  LDD0264  [8]
DBIA
 Probe Info  		C320(1.74); C44(1.24)  LDD0080  [9]
ATP probe
 Probe Info  		K698(0.00); K330(0.00); K511(0.00); K117(0.00)  LDD0199  [10]
4-Iodoacetamidophenylacetylene
 Probe Info  		C137(0.00); C320(0.00); C409(0.00); C73(0.00)  LDD0038  [11]
IA-alkyne
 Probe Info  		C36(0.00); C73(0.00)  LDD0032  [12]
IPIAA_H
 Probe Info  		N.A.  LDD0030  [13]
IPIAA_L
 Probe Info  		N.A.  LDD0031  [13]
Lodoacetamide azide
 Probe Info  		C728(0.00); C137(0.00); C320(0.00); C261(0.00)  LDD0037  [11]
ATP probe
 Probe Info  		N.A.  LDD0035  [14]
NAIA_4
 Probe Info  		C36(0.00); C44(0.00); C320(0.00); C332(0.00)  LDD2226  [15]
TFBX
 Probe Info  		N.A.  LDD0027  [16]
WYneN
 Probe Info  		C409(0.00); C332(0.00)  LDD0021  [17]
WYneO
 Probe Info  		C409(0.00); C332(0.00)  LDD0022  [17]
IPM
 Probe Info  		C409(0.00); C36(0.00); C320(0.00)  LDD0005  [17]
NHS
 Probe Info  		N.A.  LDD0010  [17]
STPyne
 Probe Info  		K574(0.00); K511(0.00)  LDD0009  [17]
VSF
 Probe Info  		C332(0.00); C483(0.00)  LDD0007  [17]
Phosphinate-6
 Probe Info  		N.A.  LDD0018  [18]
Ox-W18
 Probe Info  		N.A.  LDD2175  [19]
1c-yne
 Probe Info  		N.A.  LDD0228  [20]
Acrolein
 Probe Info  		C36(0.00); C436(0.00); C332(0.00); C409(0.00)  LDD0217  [21]
Crotonaldehyde
 Probe Info  		C73(0.00); C409(0.00)  LDD0219  [21]
Methacrolein
 Probe Info  		C409(0.00); C332(0.00); K330(0.00); C73(0.00)  LDD0218  [21]
W1
 Probe Info  		N.A.  LDD0236  [22]
AOyne
 Probe Info  		6.90  LDD0443  [23]
NAIA_5
 Probe Info  		C320(0.00); C477(0.00); C73(0.00); C332(0.00)  LDD2223  [15]
PAL-AfBPP Probe
Click To Hide/Show 8 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
FFF probe13
 Probe Info  		12.07  LDD0475  [24]
FFF probe14
 Probe Info  		13.07  LDD0477  [24]
FFF probe2
 Probe Info  		5.58  LDD0463  [24]
FFF probe3
 Probe Info  		5.62  LDD0465  [24]
STS-1
 Probe Info  		1.33  LDD0137  [25]
STS-2
 Probe Info  		N.A.  LDD0138  [25]
VE-P
 Probe Info  		N.A.  LDD0396  [26]
DA-2
 Probe Info  		N.A.  LDD0072  [27]

Competitor(s) Related to This Target

Competitor ID Name Cell line Binding Site(Ratio) Interaction ID Ref
 LDCM0548  1-(4-(Benzo[d][1,3]dioxol-5-ylmethyl)piperazin-1-yl)-2-nitroethan-1-one MDA-MB-231 C73(0.60); C332(0.93)  LDD2142  [5]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C73(0.59); C332(0.86)  LDD2112  [5]
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C73(0.86); C332(1.49); C456(0.68); C409(0.97)  LDD2117  [5]
 LDCM0558  2-Cyano-N-phenylacetamide MDA-MB-231 C73(1.43); C456(1.73)  LDD2152  [5]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C73(0.97); C332(1.13)  LDD2103  [5]
 LDCM0539  3-(4-Isopropylpiperazin-1-yl)-3-oxopropanenitrile MDA-MB-231 C456(0.75)  LDD2132  [5]
 LDCM0538  4-(Cyanoacetyl)morpholine MDA-MB-231 C73(0.79); C332(0.69)  LDD2131  [5]
 LDCM0025  4SU-RNA HEK-293T C503(2.36)  LDD0168  [7]
 LDCM0026  4SU-RNA+native RNA HEK-293T C73(2.25); C44(2.13)  LDD0169  [7]
 LDCM0214  AC1 HCT 116 C320(0.96); C332(1.06); C409(0.74); C436(1.09)  LDD0531  [9]
 LDCM0215  AC10 HCT 116 C320(0.75); C332(0.69); C409(0.57); C436(0.95)  LDD0532  [9]
 LDCM0216  AC100 HCT 116 C320(0.81); C332(1.56); C409(0.84); C436(0.67)  LDD0533  [9]
 LDCM0217  AC101 HCT 116 C320(1.01); C332(0.95); C409(0.68); C436(0.59)  LDD0534  [9]
 LDCM0218  AC102 HCT 116 C320(0.92); C332(1.10); C409(0.71); C436(0.63)  LDD0535  [9]
 LDCM0219  AC103 HCT 116 C320(0.90); C332(1.05); C409(0.64); C436(0.52)  LDD0536  [9]
 LDCM0220  AC104 HCT 116 C320(0.69); C332(1.22); C409(0.64); C436(0.57)  LDD0537  [9]
 LDCM0221  AC105 HCT 116 C320(0.86); C332(1.16); C409(0.65); C436(0.56)  LDD0538  [9]
 LDCM0222  AC106 HCT 116 C320(0.96); C332(1.20); C409(0.69); C436(0.57)  LDD0539  [9]
 LDCM0223  AC107 HCT 116 C320(0.87); C332(1.43); C409(0.73); C436(0.61)  LDD0540  [9]
 LDCM0224  AC108 HCT 116 C320(0.72); C332(1.17); C409(0.83); C436(0.60)  LDD0541  [9]
 LDCM0225  AC109 HCT 116 C320(0.77); C332(1.13); C409(0.71); C436(0.65)  LDD0542  [9]
 LDCM0226  AC11 HCT 116 C320(0.70); C332(0.69); C409(0.48); C436(0.98)  LDD0543  [9]
 LDCM0227  AC110 HCT 116 C320(0.77); C332(1.02); C409(0.69); C436(0.54)  LDD0544  [9]
 LDCM0228  AC111 HCT 116 C320(0.83); C332(0.93); C409(0.63); C436(0.56)  LDD0545  [9]
 LDCM0229  AC112 HCT 116 C320(0.84); C332(0.90); C409(0.70); C436(0.53)  LDD0546  [9]
 LDCM0230  AC113 HCT 116 C320(1.10); C332(0.92); C409(0.99); C436(0.96)  LDD0547  [9]
 LDCM0231  AC114 HCT 116 C320(0.90); C332(0.91); C409(0.89); C436(0.69)  LDD0548  [9]
 LDCM0232  AC115 HCT 116 C320(0.77); C332(0.79); C409(1.06); C436(0.71)  LDD0549  [9]
 LDCM0233  AC116 HCT 116 C320(0.83); C332(0.83); C409(1.00); C436(0.79)  LDD0550  [9]
 LDCM0234  AC117 HCT 116 C320(0.87); C332(0.75); C409(1.04); C436(0.88)  LDD0551  [9]
 LDCM0235  AC118 HCT 116 C320(0.99); C332(0.97); C409(0.86); C436(0.82)  LDD0552  [9]
 LDCM0236  AC119 HCT 116 C320(0.92); C332(0.76); C409(1.19); C436(0.73)  LDD0553  [9]
 LDCM0237  AC12 HCT 116 C320(0.98); C332(0.87); C409(0.73); C436(1.03)  LDD0554  [9]
 LDCM0238  AC120 HCT 116 C320(0.90); C332(1.04); C409(1.06); C436(0.67)  LDD0555  [9]
 LDCM0239  AC121 HCT 116 C320(1.02); C332(1.49); C409(0.96); C436(0.90)  LDD0556  [9]
 LDCM0240  AC122 HCT 116 C320(0.83); C332(0.88); C409(0.96); C436(0.69)  LDD0557  [9]
 LDCM0241  AC123 HCT 116 C320(0.91); C332(1.46); C409(0.94); C436(1.05)  LDD0558  [9]
 LDCM0242  AC124 HCT 116 C320(1.12); C332(1.30); C409(0.92); C436(0.96)  LDD0559  [9]
 LDCM0243  AC125 HCT 116 C320(0.96); C332(1.18); C409(0.85); C436(0.86)  LDD0560  [9]
 LDCM0244  AC126 HCT 116 C320(0.82); C332(1.27); C409(0.96); C436(0.74)  LDD0561  [9]
 LDCM0245  AC127 HCT 116 C320(0.85); C332(1.24); C409(0.91); C436(0.77)  LDD0562  [9]
 LDCM0246  AC128 HCT 116 C320(1.14); C409(0.71); C436(1.13); C44(1.34)  LDD0563  [9]
 LDCM0247  AC129 HCT 116 C320(1.10); C409(1.11); C436(1.32); C44(0.77)  LDD0564  [9]
 LDCM0249  AC130 HCT 116 C320(0.95); C409(0.64); C436(1.02); C44(1.04)  LDD0566  [9]
 LDCM0250  AC131 HCT 116 C320(1.02); C409(1.40); C436(1.28); C44(0.68)  LDD0567  [9]
 LDCM0251  AC132 HCT 116 C320(1.12); C409(1.33); C436(1.26); C44(0.84)  LDD0568  [9]
 LDCM0252  AC133 HCT 116 C320(1.00); C409(0.93); C436(1.08); C44(1.06)  LDD0569  [9]
 LDCM0253  AC134 HCT 116 C320(0.97); C409(0.83); C436(1.22); C44(1.08)  LDD0570  [9]
 LDCM0254  AC135 HCT 116 C320(0.98); C409(0.90); C436(1.09); C44(1.08)  LDD0571  [9]
 LDCM0255  AC136 HCT 116 C320(0.99); C409(0.90); C436(1.11); C44(1.06)  LDD0572  [9]
 LDCM0256  AC137 HCT 116 C320(1.00); C409(1.11); C436(1.23); C44(0.90)  LDD0573  [9]
 LDCM0257  AC138 HCT 116 C320(0.96); C409(1.01); C436(1.22); C44(0.97)  LDD0574  [9]
 LDCM0258  AC139 HCT 116 C320(0.98); C409(1.14); C436(1.17); C44(0.96)  LDD0575  [9]
 LDCM0259  AC14 HCT 116 C320(0.78); C332(0.86); C409(0.54); C436(0.97)  LDD0576  [9]
 LDCM0260  AC140 HCT 116 C320(1.00); C409(0.94); C436(1.09); C44(1.06)  LDD0577  [9]
 LDCM0261  AC141 HCT 116 C320(0.96); C409(1.04); C436(1.16); C44(0.98)  LDD0578  [9]
 LDCM0262  AC142 HCT 116 C320(0.98); C409(1.49); C436(1.25); C44(0.74)  LDD0579  [9]
 LDCM0263  AC143 HCT 116 C477(0.74); C483(0.74); C728(0.82); C73(0.82)  LDD0580  [9]
 LDCM0264  AC144 HCT 116 C477(0.33); C483(0.33); C409(0.55); C728(0.64)  LDD0581  [9]
 LDCM0265  AC145 HCT 116 C477(0.44); C483(0.44); C409(0.62); C728(0.74)  LDD0582  [9]
 LDCM0266  AC146 HCT 116 C477(0.30); C483(0.30); C409(0.55); C728(0.60)  LDD0583  [9]
 LDCM0267  AC147 HCT 116 C477(0.32); C483(0.32); C409(0.71); C728(0.78)  LDD0584  [9]
 LDCM0268  AC148 HCT 116 C477(0.29); C483(0.29); C728(0.57); C409(0.58)  LDD0585  [9]
 LDCM0269  AC149 HCT 116 C477(0.29); C483(0.29); C409(0.55); C728(0.61)  LDD0586  [9]
 LDCM0270  AC15 HCT 116 C409(0.56); C477(0.58); C616(0.62); C483(0.64)  LDD0587  [9]
 LDCM0271  AC150 HCT 116 C477(0.48); C483(0.48); C728(0.70); C409(0.82)  LDD0588  [9]
 LDCM0272  AC151 HCT 116 C477(0.50); C483(0.50); C728(0.77); C409(0.81)  LDD0589  [9]
 LDCM0273  AC152 HCT 116 C477(0.34); C483(0.34); C409(0.49); C728(0.64)  LDD0590  [9]
 LDCM0274  AC153 HCT 116 C477(0.29); C483(0.29); C728(0.42); C409(0.50)  LDD0591  [9]
 LDCM0621  AC154 HCT 116 C320(0.95); C332(1.09); C409(0.56); C436(1.05)  LDD2158  [9]
 LDCM0622  AC155 HCT 116 C320(0.78); C332(1.04); C409(0.56); C436(1.07)  LDD2159  [9]
 LDCM0623  AC156 HCT 116 C320(0.97); C332(0.96); C409(0.87); C436(0.97)  LDD2160  [9]
 LDCM0624  AC157 HCT 116 C320(1.24); C332(0.98); C409(0.73); C436(1.24)  LDD2161  [9]
 LDCM0276  AC17 HCT 116 C436(0.79); C320(0.82); C73(0.85); C477(0.90)  LDD0593  [9]
 LDCM0277  AC18 HCT 116 C477(0.51); C483(0.51); C73(0.69); C320(0.77)  LDD0594  [9]
 LDCM0278  AC19 HCT 116 C477(0.72); C483(0.72); C320(0.79); C73(0.89)  LDD0595  [9]
 LDCM0279  AC2 HCT 116 C477(0.47); C483(0.68); C616(0.78); C320(0.83)  LDD0596  [9]
 LDCM0280  AC20 HCT 116 C409(0.84); C320(0.85); C436(0.88); C332(0.92)  LDD0597  [9]
 LDCM0281  AC21 HCT 116 C477(0.75); C483(0.75); C73(0.85); C320(0.87)  LDD0598  [9]
 LDCM0282  AC22 HCT 116 C477(0.80); C483(0.80); C436(0.81); C332(0.91)  LDD0599  [9]
 LDCM0283  AC23 HCT 116 C73(0.79); C320(0.81); C477(0.83); C483(0.83)  LDD0600  [9]
 LDCM0284  AC24 HCT 116 C320(0.84); C436(0.99); C332(1.01); C73(1.05)  LDD0601  [9]
 LDCM0285  AC25 HCT 116 C436(0.78); C728(0.79); C477(0.80); C483(0.80)  LDD0602  [9]
 LDCM0286  AC26 HCT 116 C477(0.58); C483(0.58); C320(0.69); C436(0.70)  LDD0603  [9]
 LDCM0287  AC27 HCT 116 C477(0.41); C483(0.41); C728(0.61); C436(0.62)  LDD0604  [9]
 LDCM0288  AC28 HCT 116 C477(0.54); C483(0.54); C436(0.65); C320(0.72)  LDD0605  [9]
 LDCM0289  AC29 HCT 116 C477(0.53); C483(0.53); C436(0.61); C728(0.63)  LDD0606  [9]
 LDCM0290  AC3 HCT 116 C477(0.50); C483(0.65); C320(0.86); C616(0.86)  LDD0607  [9]
 LDCM0291  AC30 HCT 116 C477(0.46); C483(0.46); C436(0.58); C728(0.63)  LDD0608  [9]
 LDCM0292  AC31 HCT 116 C477(0.39); C483(0.39); C728(0.67); C320(0.69)  LDD0609  [9]
 LDCM0293  AC32 HCT 116 C477(0.42); C483(0.42); C436(0.56); C728(0.56)  LDD0610  [9]
 LDCM0294  AC33 HCT 116 C477(0.40); C483(0.40); C728(0.55); C436(0.56)  LDD0611  [9]
 LDCM0295  AC34 HCT 116 C477(0.40); C483(0.40); C728(0.57); C436(0.60)  LDD0612  [9]
 LDCM0296  AC35 HCT 116 C616(0.59); C477(1.07); C483(1.07); C728(1.11)  LDD0613  [9]
 LDCM0297  AC36 HCT 116 C616(0.49); C728(0.93); C332(0.96); C477(1.06)  LDD0614  [9]
 LDCM0298  AC37 HCT 116 C616(0.73); C332(0.78); C728(0.90); C73(1.03)  LDD0615  [9]
 LDCM0299  AC38 HCT 116 C616(0.80); C73(0.97); C728(0.98); C332(1.05)  LDD0616  [9]
 LDCM0300  AC39 HCT 116 C616(0.50); C320(0.94); C728(0.95); C436(0.99)  LDD0617  [9]
 LDCM0301  AC4 HCT 116 C477(0.37); C483(0.57); C616(0.81); C728(0.84)  LDD0618  [9]
 LDCM0302  AC40 HCT 116 C728(0.88); C616(0.90); C73(0.91); C409(0.95)  LDD0619  [9]
 LDCM0303  AC41 HCT 116 C616(0.53); C332(0.63); C728(0.85); C73(1.11)  LDD0620  [9]
 LDCM0304  AC42 HCT 116 C616(0.68); C728(0.87); C332(0.99); C73(1.04)  LDD0621  [9]
 LDCM0305  AC43 HCT 116 C332(0.70); C616(0.73); C728(0.82); C73(0.93)  LDD0622  [9]
 LDCM0306  AC44 HCT 116 C616(0.64); C332(0.69); C728(0.87); C477(0.98)  LDD0623  [9]
 LDCM0307  AC45 HCT 116 C332(0.67); C616(0.83); C728(0.90); C436(0.95)  LDD0624  [9]
 LDCM0308  AC46 HCT 116 C332(0.66); C73(0.86); C320(0.87); C436(0.87)  LDD0625  [9]
 LDCM0309  AC47 HCT 116 C332(0.76); C436(0.80); C73(0.88); C728(0.91)  LDD0626  [9]
 LDCM0310  AC48 HCT 116 C477(0.70); C483(0.70); C436(0.73); C332(0.78)  LDD0627  [9]
 LDCM0311  AC49 HCT 116 C477(0.68); C483(0.68); C436(0.73); C73(0.73)  LDD0628  [9]
 LDCM0312  AC5 HCT 116 C477(0.39); C616(0.47); C483(0.59); C728(0.92)  LDD0629  [9]
 LDCM0313  AC50 HCT 116 C436(0.70); C477(0.76); C483(0.76); C728(0.78)  LDD0630  [9]
 LDCM0314  AC51 HCT 116 C332(0.80); C436(0.92); C728(0.96); C320(0.97)  LDD0631  [9]
 LDCM0315  AC52 HCT 116 C332(0.69); C477(0.73); C483(0.73); C436(0.82)  LDD0632  [9]
 LDCM0316  AC53 HCT 116 C436(0.73); C477(0.84); C483(0.84); C409(0.84)  LDD0633  [9]
 LDCM0317  AC54 HCT 116 C436(0.83); C73(0.86); C477(0.87); C483(0.87)  LDD0634  [9]
 LDCM0318  AC55 HCT 116 C436(0.71); C477(0.72); C483(0.72); C332(0.83)  LDD0635  [9]
 LDCM0319  AC56 HCT 116 C332(0.66); C436(0.67); C477(0.72); C483(0.72)  LDD0636  [9]
 LDCM0320  AC57 HCT 116 C477(0.34); C483(0.37); C73(0.54); C409(0.59)  LDD0637  [9]
 LDCM0321  AC58 HCT 116 C483(0.31); C477(0.31); C73(0.48); C409(0.54)  LDD0638  [9]
 LDCM0322  AC59 HCT 116 C477(0.35); C483(0.37); C409(0.46); C73(0.50)  LDD0639  [9]
 LDCM0323  AC6 HCT 116 C477(0.54); C332(0.60); C483(0.61); C409(0.63)  LDD0640  [9]
 LDCM0324  AC60 HCT 116 C477(0.28); C483(0.36); C73(0.46); C409(0.49)  LDD0641  [9]
 LDCM0325  AC61 HCT 116 C477(0.26); C483(0.30); C409(0.45); C320(0.53)  LDD0642  [9]
 LDCM0326  AC62 HCT 116 C477(0.35); C483(0.38); C409(0.47); C73(0.57)  LDD0643  [9]
 LDCM0327  AC63 HCT 116 C477(0.30); C483(0.31); C73(0.49); C409(0.50)  LDD0644  [9]
 LDCM0328  AC64 HCT 116 C477(0.33); C483(0.34); C73(0.47); C409(0.49)  LDD0645  [9]
 LDCM0329  AC65 HCT 116 C477(0.34); C483(0.38); C409(0.53); C73(0.60)  LDD0646  [9]
 LDCM0330  AC66 HCT 116 C477(0.33); C483(0.39); C409(0.57); C73(0.58)  LDD0647  [9]
 LDCM0331  AC67 HCT 116 C477(0.28); C483(0.32); C409(0.49); C73(0.50)  LDD0648  [9]
 LDCM0332  AC68 HCT 116 C728(0.83); C73(0.90); C436(0.90); C320(0.93)  LDD0649  [9]
 LDCM0333  AC69 HCT 116 C409(0.74); C728(0.81); C320(0.86); C73(0.92)  LDD0650  [9]
 LDCM0334  AC7 HCT 116 C616(0.59); C332(0.62); C477(0.72); C409(0.78)  LDD0651  [9]
 LDCM0335  AC70 HCT 116 C409(0.71); C728(0.78); C73(0.78); C320(0.79)  LDD0652  [9]
 LDCM0336  AC71 HCT 116 C728(0.91); C409(0.96); C320(0.98); C73(0.98)  LDD0653  [9]
 LDCM0337  AC72 HCT 116 C728(0.81); C409(0.85); C320(0.91); C436(0.91)  LDD0654  [9]
 LDCM0338  AC73 HCT 116 C728(0.73); C436(0.89); C409(0.90); C73(0.94)  LDD0655  [9]
 LDCM0339  AC74 HCT 116 C409(0.83); C728(0.86); C73(0.94); C320(0.99)  LDD0656  [9]
 LDCM0340  AC75 HCT 116 C728(0.76); C409(0.82); C73(0.89); C436(0.92)  LDD0657  [9]
 LDCM0341  AC76 HCT 116 C409(0.70); C73(0.80); C728(0.84); C320(0.91)  LDD0658  [9]
 LDCM0342  AC77 HCT 116 C409(0.71); C728(0.73); C73(0.84); C320(0.85)  LDD0659  [9]
 LDCM0343  AC78 HCT 116 C728(0.74); C409(0.76); C320(0.83); C436(0.89)  LDD0660  [9]
 LDCM0344  AC79 HCT 116 C728(0.83); C320(0.90); C73(0.94); C436(0.97)  LDD0661  [9]
 LDCM0345  AC8 HCT 116 C616(0.58); C409(0.64); C477(0.68); C73(0.70)  LDD0662  [9]
 LDCM0346  AC80 HCT 116 C332(0.86); C728(0.87); C320(0.97); C73(0.97)  LDD0663  [9]
 LDCM0347  AC81 HCT 116 C436(0.94); C728(0.99); C320(0.99); C409(0.99)  LDD0664  [9]
 LDCM0348  AC82 HCT 116 C320(0.88); C73(0.88); C409(0.88); C728(0.89)  LDD0665  [9]
 LDCM0349  AC83 HCT 116 C728(0.57); C73(0.60); C477(0.61); C483(0.61)  LDD0666  [9]
 LDCM0350  AC84 HCT 116 C728(0.53); C73(0.56); C477(0.57); C483(0.57)  LDD0667  [9]
 LDCM0351  AC85 HCT 116 C728(0.56); C332(0.60); C477(0.61); C483(0.61)  LDD0668  [9]
 LDCM0352  AC86 HCT 116 C728(0.68); C73(0.70); C477(0.74); C483(0.74)  LDD0669  [9]
 LDCM0353  AC87 HCT 116 C436(0.84); C728(0.88); C73(0.91); C477(0.91)  LDD0670  [9]
 LDCM0354  AC88 HCT 116 C728(0.79); C477(0.83); C483(0.83); C332(0.95)  LDD0671  [9]
 LDCM0355  AC89 HCT 116 C728(0.64); C477(0.66); C483(0.66); C73(0.71)  LDD0672  [9]
 LDCM0357  AC90 HCT 116 C409(0.84); C436(0.90); C332(0.97); C477(1.03)  LDD0674  [9]
 LDCM0358  AC91 HCT 116 C728(0.60); C73(0.67); C477(0.70); C483(0.70)  LDD0675  [9]
 LDCM0359  AC92 HCT 116 C728(0.57); C477(0.62); C483(0.62); C73(0.69)  LDD0676  [9]
 LDCM0360  AC93 HCT 116 C728(0.66); C73(0.77); C332(0.77); C477(0.79)  LDD0677  [9]
 LDCM0361  AC94 HCT 116 C728(0.62); C332(0.65); C477(0.68); C483(0.68)  LDD0678  [9]
 LDCM0362  AC95 HCT 116 C728(0.60); C477(0.70); C483(0.70); C73(0.75)  LDD0679  [9]
 LDCM0363  AC96 HCT 116 C728(0.56); C477(0.60); C483(0.60); C73(0.70)  LDD0680  [9]
 LDCM0364  AC97 HCT 116 C728(0.57); C477(0.65); C483(0.65); C332(0.65)  LDD0681  [9]
 LDCM0365  AC98 HCT 116 C477(0.15); C483(0.15); C436(0.47); C728(0.47)  LDD0682  [9]
 LDCM0366  AC99 HCT 116 C477(0.44); C483(0.44); C728(0.60); C436(0.64)  LDD0683  [9]
 LDCM0545  Acetamide MDA-MB-231 C73(0.46)  LDD2138  [5]
 LDCM0520  AKOS000195272 MDA-MB-231 C73(0.75)  LDD2113  [5]
 LDCM0248  AKOS034007472 HCT 116 C320(0.99); C332(1.30); C409(0.76); C436(1.03)  LDD0565  [9]
 LDCM0356  AKOS034007680 HCT 116 C616(0.62); C332(0.65); C409(0.66); C477(0.67)  LDD0673  [9]
 LDCM0275  AKOS034007705 HCT 116 C477(0.48); C409(0.49); C332(0.52); C483(0.52)  LDD0592  [9]
 LDCM0156  Aniline NCI-H1299 N.A.  LDD0404  [1]
 LDCM0020  ARS-1620 HCC44 C73(1.17)  LDD2171  [9]
 LDCM0498  BS-3668 MDA-MB-231 C73(0.56); C332(0.34); C456(0.57)  LDD2091  [5]
 LDCM0630  CCW28-3 231MFP C44(1.42)  LDD2214  [28]
 LDCM0108  Chloroacetamide HeLa C436(0.00); C36(0.00); C409(0.00); C332(0.00)  LDD0222  [21]
 LDCM0070  Cisar_cp37 MDA-MB-231 2.78  LDD0120  [6]
 LDCM0632  CL-Sc Hep-G2 C332(20.00); C36(20.00); C36(0.53)  LDD2227  [15]
 LDCM0367  CL1 HCT 116 C73(0.86); C616(1.03); C409(1.04); C332(1.09)  LDD0684  [9]
 LDCM0368  CL10 HCT 116 C477(0.51); C483(0.55); C332(0.58); C320(0.71)  LDD0685  [9]
 LDCM0369  CL100 HCT 116 C477(0.42); C483(0.59); C728(0.87); C409(0.88)  LDD0686  [9]
 LDCM0370  CL101 HCT 116 C616(0.56); C477(0.63); C409(0.63); C332(0.65)  LDD0687  [9]
 LDCM0371  CL102 HCT 116 C616(0.64); C477(0.73); C409(0.73); C483(0.77)  LDD0688  [9]
 LDCM0372  CL103 HCT 116 C477(0.72); C483(0.75); C616(0.76); C332(0.79)  LDD0689  [9]
 LDCM0373  CL104 HCT 116 C409(0.67); C332(0.73); C320(0.78); C477(0.80)  LDD0690  [9]
 LDCM0374  CL105 HCT 116 C477(0.52); C483(0.52); C320(0.75); C73(0.80)  LDD0691  [9]
 LDCM0375  CL106 HCT 116 C477(0.41); C483(0.41); C73(0.72); C320(0.83)  LDD0692  [9]
 LDCM0376  CL107 HCT 116 C477(0.54); C483(0.54); C73(0.74); C436(0.80)  LDD0693  [9]
 LDCM0377  CL108 HCT 116 C477(0.50); C483(0.50); C73(0.75); C320(0.81)  LDD0694  [9]
 LDCM0378  CL109 HCT 116 C477(0.59); C483(0.59); C73(0.72); C436(0.74)  LDD0695  [9]
 LDCM0379  CL11 HCT 116 C477(0.55); C483(0.59); C332(0.66); C436(0.83)  LDD0696  [9]
 LDCM0380  CL110 HCT 116 C477(0.61); C483(0.61); C73(0.67); C320(0.68)  LDD0697  [9]
 LDCM0381  CL111 HCT 116 C477(0.69); C483(0.69); C320(0.81); C436(0.84)  LDD0698  [9]
 LDCM0382  CL112 HCT 116 C436(0.91); C320(0.94); C728(0.96); C477(0.96)  LDD0699  [9]
 LDCM0383  CL113 HCT 116 C477(0.49); C483(0.49); C728(0.59); C436(0.63)  LDD0700  [9]
 LDCM0384  CL114 HCT 116 C477(0.45); C483(0.45); C436(0.62); C728(0.64)  LDD0701  [9]
 LDCM0385  CL115 HCT 116 C477(0.45); C483(0.45); C436(0.61); C728(0.64)  LDD0702  [9]
 LDCM0386  CL116 HCT 116 C477(0.54); C483(0.54); C436(0.59); C728(0.63)  LDD0703  [9]
 LDCM0387  CL117 HCT 116 C73(0.79); C409(0.95); C477(0.99); C483(0.99)  LDD0704  [9]
 LDCM0388  CL118 HCT 116 C616(0.63); C728(0.85); C332(0.90); C320(1.03)  LDD0705  [9]
 LDCM0389  CL119 HCT 116 C332(0.83); C728(0.85); C616(0.93); C73(0.94)  LDD0706  [9]
 LDCM0390  CL12 HCT 116 C477(0.61); C483(0.69); C332(0.73); C320(0.91)  LDD0707  [9]
 LDCM0391  CL120 HCT 116 C616(0.62); C332(0.72); C728(0.92); C320(1.07)  LDD0708  [9]
 LDCM0392  CL121 HCT 116 C332(0.70); C436(0.80); C73(0.83); C320(0.88)  LDD0709  [9]
 LDCM0393  CL122 HCT 116 C477(0.64); C483(0.64); C332(0.66); C436(0.67)  LDD0710  [9]
 LDCM0394  CL123 HCT 116 C73(0.68); C436(0.72); C332(0.75); C477(0.79)  LDD0711  [9]
 LDCM0395  CL124 HCT 116 C332(0.70); C436(0.72); C73(0.73); C477(0.75)  LDD0712  [9]
 LDCM0396  CL125 HCT 116 C409(0.69); C483(0.69); C477(0.77); C332(0.80)  LDD0713  [9]
 LDCM0397  CL126 HCT 116 C483(0.50); C477(0.52); C409(0.61); C320(0.66)  LDD0714  [9]
 LDCM0398  CL127 HCT 116 C477(0.51); C483(0.52); C409(0.55); C73(0.66)  LDD0715  [9]
 LDCM0399  CL128 HCT 116 C477(0.36); C483(0.41); C409(0.55); C320(0.63)  LDD0716  [9]
 LDCM0400  CL13 HCT 116 C477(0.52); C483(0.60); C332(0.73); C320(0.74)  LDD0717  [9]
 LDCM0401  CL14 HCT 116 C332(0.76); C477(0.87); C483(0.92); C436(0.92)  LDD0718  [9]
 LDCM0402  CL15 HCT 116 C477(0.56); C483(0.61); C320(0.71); C332(0.77)  LDD0719  [9]
 LDCM0403  CL16 HCT 116 C477(0.55); C483(0.64); C332(0.75); C320(0.77)  LDD0720  [9]
 LDCM0404  CL17 HCT 116 C477(0.49); C332(0.58); C483(0.67); C73(0.72)  LDD0721  [9]
 LDCM0405  CL18 HCT 116 C477(0.32); C332(0.58); C483(0.60); C728(0.67)  LDD0722  [9]
 LDCM0406  CL19 HCT 116 C477(0.37); C332(0.65); C483(0.67); C728(0.80)  LDD0723  [9]
 LDCM0407  CL2 HCT 116 C616(0.76); C483(0.94); C436(0.97); C477(0.98)  LDD0724  [9]
 LDCM0408  CL20 HCT 116 C477(0.40); C332(0.51); C73(0.59); C483(0.59)  LDD0725  [9]
 LDCM0409  CL21 HCT 116 C477(0.41); C483(0.55); C332(0.56); C728(0.68)  LDD0726  [9]
 LDCM0410  CL22 HCT 116 C477(0.39); C332(0.59); C483(0.61); C728(0.76)  LDD0727  [9]
 LDCM0411  CL23 HCT 116 C477(0.52); C483(0.64); C332(0.69); C728(0.71)  LDD0728  [9]
 LDCM0412  CL24 HCT 116 C477(0.41); C332(0.62); C73(0.65); C483(0.78)  LDD0729  [9]
 LDCM0413  CL25 HCT 116 C320(0.75); C332(0.70); C436(1.30); C477(0.36)  LDD0730  [9]
 LDCM0414  CL26 HCT 116 C320(0.79); C332(0.65); C436(0.90); C477(0.43)  LDD0731  [9]
 LDCM0415  CL27 HCT 116 C320(0.94); C332(0.59); C436(1.33); C477(0.58)  LDD0732  [9]
 LDCM0416  CL28 HCT 116 C320(0.81); C332(0.63); C436(1.15); C477(0.38)  LDD0733  [9]
 LDCM0417  CL29 HCT 116 C320(0.87); C332(0.62); C436(1.44); C477(0.40)  LDD0734  [9]
 LDCM0418  CL3 HCT 116 C320(0.88); C332(0.86); C409(0.87); C436(0.92)  LDD0735  [9]
 LDCM0419  CL30 HCT 116 C320(0.91); C332(1.11); C436(1.60); C477(0.42)  LDD0736  [9]
 LDCM0420  CL31 HCT 116 C320(0.98); C332(0.82); C409(0.45); C436(0.86)  LDD0737  [9]
 LDCM0421  CL32 HCT 116 C320(1.10); C332(0.65); C409(0.26); C436(0.77)  LDD0738  [9]
 LDCM0422  CL33 HCT 116 C320(0.78); C332(0.63); C409(0.34); C436(0.68)  LDD0739  [9]
 LDCM0423  CL34 HCT 116 C320(0.80); C332(0.69); C409(0.28); C436(0.77)  LDD0740  [9]
 LDCM0424  CL35 HCT 116 C320(0.83); C332(0.69); C409(0.33); C436(0.65)  LDD0741  [9]
 LDCM0425  CL36 HCT 116 C320(0.80); C332(0.85); C409(0.51); C436(0.72)  LDD0742  [9]
 LDCM0426  CL37 HCT 116 C320(0.87); C332(0.71); C409(0.37); C436(0.68)  LDD0743  [9]
 LDCM0428  CL39 HCT 116 C320(1.11); C332(0.69); C409(0.34); C436(0.82)  LDD0745  [9]
 LDCM0429  CL4 HCT 116 C320(1.00); C332(1.01); C409(0.84); C436(0.86)  LDD0746  [9]
 LDCM0430  CL40 HCT 116 C320(0.89); C332(0.66); C409(0.29); C436(0.81)  LDD0747  [9]
 LDCM0431  CL41 HCT 116 C320(1.04); C332(0.85); C409(0.47); C436(0.81)  LDD0748  [9]
 LDCM0432  CL42 HCT 116 C320(0.90); C332(0.74); C409(0.39); C436(0.69)  LDD0749  [9]
 LDCM0433  CL43 HCT 116 C320(0.99); C332(0.80); C409(0.32); C436(0.80)  LDD0750  [9]
 LDCM0434  CL44 HCT 116 C320(1.00); C332(0.71); C409(0.35); C436(0.66)  LDD0751  [9]
 LDCM0435  CL45 HCT 116 C320(0.85); C332(0.59); C409(0.36); C436(0.65)  LDD0752  [9]
 LDCM0436  CL46 HCT 116 C320(0.74); C332(0.79); C409(2.32); C436(1.08)  LDD0753  [9]
 LDCM0437  CL47 HCT 116 C320(0.85); C332(0.57); C409(1.67); C436(1.18)  LDD0754  [9]
 LDCM0438  CL48 HCT 116 C320(0.87); C332(0.70); C409(1.89); C436(1.33)  LDD0755  [9]
 LDCM0439  CL49 HCT 116 C320(1.02); C332(1.29); C409(1.38); C436(0.98)  LDD0756  [9]
 LDCM0440  CL5 HCT 116 C320(0.84); C332(0.96); C409(0.91); C436(1.04)  LDD0757  [9]
 LDCM0441  CL50 HCT 116 C320(1.00); C332(0.91); C409(1.51); C436(1.28)  LDD0758  [9]
 LDCM0442  CL51 HCT 116 C320(0.95); C332(0.86); C409(1.70); C436(1.12)  LDD0759  [9]
 LDCM0443  CL52 HCT 116 C320(0.83); C332(1.11); C409(1.69); C436(1.14)  LDD0760  [9]
 LDCM0444  CL53 HCT 116 C320(0.82); C332(0.81); C409(1.60); C436(1.26)  LDD0761  [9]
 LDCM0445  CL54 HCT 116 C320(0.81); C332(0.71); C409(1.56); C436(1.20)  LDD0762  [9]
 LDCM0446  CL55 HCT 116 C320(1.04); C332(0.79); C409(1.98); C436(1.10)  LDD0763  [9]
 LDCM0447  CL56 HCT 116 C320(0.96); C332(0.69); C409(1.43); C436(0.93)  LDD0764  [9]
 LDCM0448  CL57 HCT 116 C320(1.11); C332(0.73); C409(1.51); C436(1.13)  LDD0765  [9]
 LDCM0449  CL58 HCT 116 C320(0.84); C332(1.01); C409(1.72); C436(1.21)  LDD0766  [9]
 LDCM0450  CL59 HCT 116 C320(1.01); C332(0.91); C409(1.39); C436(1.08)  LDD0767  [9]
 LDCM0451  CL6 HCT 116 C320(0.70); C332(0.70); C409(0.81); C436(0.78)  LDD0768  [9]
 LDCM0452  CL60 HCT 116 C320(0.91); C332(0.71); C409(1.45); C436(0.94)  LDD0769  [9]
 LDCM0453  CL61 HCT 116 C332(0.98); C409(0.61); C436(0.86); C44(1.02)  LDD0770  [9]
 LDCM0454  CL62 HCT 116 C332(0.85); C409(0.53); C436(0.87); C44(1.10)  LDD0771  [9]
 LDCM0455  CL63 HCT 116 C332(0.72); C409(0.48); C436(0.69); C44(1.07)  LDD0772  [9]
 LDCM0456  CL64 HCT 116 C332(0.93); C409(0.40); C436(0.74); C44(1.23)  LDD0773  [9]
 LDCM0457  CL65 HCT 116 C332(0.97); C409(0.48); C436(0.82); C44(1.06)  LDD0774  [9]
 LDCM0458  CL66 HCT 116 C332(0.89); C409(0.33); C436(0.71); C44(1.82)  LDD0775  [9]
 LDCM0459  CL67 HCT 116 C332(0.97); C409(0.40); C436(0.68); C44(1.46)  LDD0776  [9]
 LDCM0460  CL68 HCT 116 C332(1.41); C409(0.38); C436(0.59); C44(1.32)  LDD0777  [9]
 LDCM0461  CL69 HCT 116 C332(0.75); C409(0.42); C436(0.65); C44(1.00)  LDD0778  [9]
 LDCM0462  CL7 HCT 116 C320(0.79); C332(0.71); C409(1.05); C436(0.95)  LDD0779  [9]
 LDCM0463  CL70 HCT 116 C332(0.97); C409(0.46); C436(0.70); C44(1.15)  LDD0780  [9]
 LDCM0464  CL71 HCT 116 C332(0.98); C409(0.45); C436(0.67); C44(1.14)  LDD0781  [9]
 LDCM0465  CL72 HCT 116 C332(0.97); C409(0.65); C436(0.76); C44(1.11)  LDD0782  [9]
 LDCM0466  CL73 HCT 116 C332(1.03); C409(0.57); C436(0.71); C44(1.28)  LDD0783  [9]
 LDCM0467  CL74 HCT 116 C332(0.89); C409(0.49); C436(0.74); C44(1.14)  LDD0784  [9]
 LDCM0469  CL76 HCT 116 C332(0.79); C409(0.49); C436(0.79); C44(1.29)  LDD0786  [9]
 LDCM0470  CL77 HCT 116 C332(0.86); C409(0.47); C436(1.06); C44(1.15)  LDD0787  [9]
 LDCM0471  CL78 HCT 116 C332(0.73); C409(0.44); C436(0.87); C44(1.35)  LDD0788  [9]
 LDCM0472  CL79 HCT 116 C332(0.87); C409(0.39); C436(0.77); C44(1.93)  LDD0789  [9]
 LDCM0473  CL8 HCT 116 C320(0.91); C332(0.60); C409(0.88); C436(0.59)  LDD0790  [9]
 LDCM0474  CL80 HCT 116 C332(0.76); C409(0.43); C436(0.93); C44(1.30)  LDD0791  [9]
 LDCM0475  CL81 HCT 116 C332(0.89); C409(0.51); C436(0.79); C44(1.30)  LDD0792  [9]
 LDCM0476  CL82 HCT 116 C332(0.87); C409(0.38); C436(0.89); C44(2.10)  LDD0793  [9]
 LDCM0477  CL83 HCT 116 C332(0.76); C409(0.38); C436(0.82); C44(2.28)  LDD0794  [9]
 LDCM0478  CL84 HCT 116 C332(0.73); C409(0.35); C436(0.78); C44(2.79)  LDD0795  [9]
 LDCM0479  CL85 HCT 116 C332(0.84); C409(0.42); C436(0.77); C44(1.57)  LDD0796  [9]
 LDCM0480  CL86 HCT 116 C332(0.85); C409(0.59); C436(0.81); C44(1.34)  LDD0797  [9]
 LDCM0481  CL87 HCT 116 C332(0.91); C409(0.45); C436(0.88); C44(1.69)  LDD0798  [9]
 LDCM0482  CL88 HCT 116 C332(0.85); C409(0.38); C436(0.75); C44(1.98)  LDD0799  [9]
 LDCM0483  CL89 HCT 116 C332(0.85); C409(0.38); C436(0.94); C44(3.00)  LDD0800  [9]
 LDCM0484  CL9 HCT 116 C320(0.94); C332(0.74); C409(0.86); C436(0.80)  LDD0801  [9]
 LDCM0485  CL90 HCT 116 C332(1.37); C409(1.42); C436(0.94); C44(1.12)  LDD0802  [9]
 LDCM0486  CL91 HCT 116 C320(0.73); C332(1.09); C409(0.77); C436(0.81)  LDD0803  [9]
 LDCM0487  CL92 HCT 116 C320(0.73); C332(1.37); C409(0.80); C436(0.79)  LDD0804  [9]
 LDCM0488  CL93 HCT 116 C320(0.90); C332(1.36); C409(0.85); C436(1.01)  LDD0805  [9]
 LDCM0489  CL94 HCT 116 C320(0.86); C332(1.53); C409(0.80); C436(0.93)  LDD0806  [9]
 LDCM0490  CL95 HCT 116 C320(0.70); C332(1.08); C409(0.74); C436(0.82)  LDD0807  [9]
 LDCM0491  CL96 HCT 116 C320(0.80); C332(1.00); C409(0.76); C436(0.82)  LDD0808  [9]
 LDCM0492  CL97 HCT 116 C320(0.77); C332(0.89); C409(0.80); C436(0.76)  LDD0809  [9]
 LDCM0493  CL98 HCT 116 C320(0.75); C332(0.81); C409(0.83); C436(0.95)  LDD0810  [9]
 LDCM0494  CL99 HCT 116 C320(0.79); C332(0.90); C409(0.75); C436(1.02)  LDD0811  [9]
 LDCM0634  CY-0357 Hep-G2 C409(2.30); C36(0.69)  LDD2228  [15]
 LDCM0495  E2913 HEK-293T C409(1.00); C73(0.81); C332(1.00); C36(0.93)  LDD1698  [29]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C332(5.16); C73(2.95); C36(2.45); C320(2.23)  LDD1702  [5]
 LDCM0625  F8 Ramos C73(0.75); C409(0.93); C332(1.43); C36(1.02)  LDD2187  [30]
 LDCM0572  Fragment10 MDA-MB-231 C44(12.44)  LDD1465  [31]
 LDCM0573  Fragment11 MDA-MB-231 C44(1.06)  LDD1467  [31]
 LDCM0574  Fragment12 MDA-MB-231 C44(4.70)  LDD1468  [31]
 LDCM0575  Fragment13 MDA-MB-231 C44(1.04)  LDD1469  [31]
 LDCM0576  Fragment14 MDA-MB-231 C44(1.99)  LDD1471  [31]
 LDCM0579  Fragment20 Ramos C73(0.62); C409(0.81); C332(1.17); C36(0.68)  LDD2194  [30]
 LDCM0580  Fragment21 MDA-MB-231 C44(1.30)  LDD1473  [31]
 LDCM0582  Fragment23 Ramos C73(0.81); C409(0.81); C332(0.65); C36(0.91)  LDD2196  [30]
 LDCM0578  Fragment27 MDA-MB-231 C44(0.80)  LDD1474  [31]
 LDCM0586  Fragment28 Ramos C73(0.83); C409(0.80); C332(0.90); C36(0.47)  LDD2198  [30]
 LDCM0587  Fragment29 Ramos C44(1.09)  LDD1476  [31]
 LDCM0588  Fragment30 Ramos C73(0.95); C409(1.11); C332(1.20); C36(1.14)  LDD2199  [30]
 LDCM0589  Fragment31 MDA-MB-231 C44(0.56)  LDD1477  [31]
 LDCM0590  Fragment32 Ramos C73(0.49); C409(1.05); C332(1.14); C36(0.72)  LDD2201  [30]
 LDCM0468  Fragment33 HCT 116 C332(1.11); C409(0.42); C436(0.66); C44(1.12)  LDD0785  [9]
 LDCM0596  Fragment38 MDA-MB-231 C44(1.17)  LDD1480  [31]
 LDCM0566  Fragment4 MDA-MB-231 C44(1.84)  LDD1461  [31]
 LDCM0599  Fragment41 MDA-MB-231 C44(0.75)  LDD1481  [31]
 LDCM0603  Fragment45 MDA-MB-231 C44(2.50)  LDD1482  [31]
 LDCM0427  Fragment51 HCT 116 C320(0.84); C332(0.83); C409(0.30); C436(0.69)  LDD0744  [9]
 LDCM0610  Fragment52 Ramos C73(1.37); C409(1.44); C332(1.36); C36(1.10)  LDD2204  [30]
 LDCM0614  Fragment56 MDA-MB-231 C44(0.99)  LDD1484  [31]
 LDCM0569  Fragment7 Ramos C73(0.81); C409(1.22); C332(1.34); C36(0.84)  LDD2186  [30]
 LDCM0570  Fragment8 MDA-MB-231 C44(1.95)  LDD1462  [31]
 LDCM0571  Fragment9 Ramos C44(1.35)  LDD1464  [31]
 LDCM0116  HHS-0101 DM93 Y64(0.81); Y294(1.40); Y461(1.41)  LDD0264  [8]
 LDCM0117  HHS-0201 DM93 Y64(0.57); Y461(0.79)  LDD0265  [8]
 LDCM0118  HHS-0301 DM93 Y294(0.41); Y461(0.99)  LDD0266  [8]
 LDCM0119  HHS-0401 DM93 Y64(0.84); Y294(0.94); Y461(1.53)  LDD0267  [8]
 LDCM0120  HHS-0701 DM93 Y64(1.25); Y461(1.40); Y294(1.56)  LDD0268  [8]
 LDCM0107  IAA HeLa C409(0.00); C73(0.00); C36(0.00)  LDD0221  [21]
 LDCM0022  KB02 HCT 116 C320(1.74); C44(1.24)  LDD0080  [9]
 LDCM0023  KB03 HCT 116 C320(2.15); C44(1.15)  LDD0081  [9]
 LDCM0024  KB05 HCT 116 C320(1.94); C44(0.91)  LDD0082  [9]
 LDCM0509  N-(4-bromo-3,5-dimethylphenyl)-2-nitroacetamide MDA-MB-231 C73(1.13); C332(0.89)  LDD2102  [5]
 LDCM0528  N-(4-bromophenyl)-2-cyano-N-phenylacetamide MDA-MB-231 C332(0.52); C456(0.73)  LDD2121  [5]
 LDCM0109  NEM HeLa H561(0.00); H570(0.00); H724(0.00)  LDD0223  [21]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C73(0.65); C332(0.45)  LDD2089  [5]
 LDCM0497  Nucleophilic fragment 11b MDA-MB-231 C73(1.16); C456(1.38)  LDD2090  [5]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C332(0.91)  LDD2092  [5]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C73(1.00); C456(0.86)  LDD2093  [5]
 LDCM0501  Nucleophilic fragment 13b MDA-MB-231 C332(1.06)  LDD2094  [5]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C332(0.91); C456(0.08)  LDD2096  [5]
 LDCM0504  Nucleophilic fragment 15a MDA-MB-231 C73(0.91)  LDD2097  [5]
 LDCM0505  Nucleophilic fragment 15b MDA-MB-231 C73(0.75); C332(1.03)  LDD2098  [5]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C73(1.07); C332(0.84); C456(0.98); C409(1.00)  LDD2099  [5]
 LDCM0507  Nucleophilic fragment 16b MDA-MB-231 C332(0.86); C456(1.27); C36(0.59)  LDD2100  [5]
 LDCM0508  Nucleophilic fragment 17a MDA-MB-231 C73(0.78)  LDD2101  [5]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C332(0.82); C456(0.62); C36(0.43)  LDD2104  [5]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C73(0.93); C332(1.53)  LDD2105  [5]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C73(1.06); C332(1.00); C409(1.12)  LDD2107  [5]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C73(0.54); C332(0.71)  LDD2108  [5]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C73(0.62); C332(0.47); C456(0.46)  LDD2109  [5]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C73(1.12); C332(1.05); C409(1.35)  LDD2111  [5]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C73(0.64); C332(0.63)  LDD2114  [5]
 LDCM0522  Nucleophilic fragment 24a MDA-MB-231 C73(0.42)  LDD2115  [5]
 LDCM0523  Nucleophilic fragment 24b MDA-MB-231 C332(1.25)  LDD2116  [5]
 LDCM0525  Nucleophilic fragment 25b MDA-MB-231 C332(1.35)  LDD2118  [5]
 LDCM0526  Nucleophilic fragment 26a MDA-MB-231 C332(0.92); C456(3.25)  LDD2119  [5]
 LDCM0527  Nucleophilic fragment 26b MDA-MB-231 C332(0.78)  LDD2120  [5]
 LDCM0529  Nucleophilic fragment 27b MDA-MB-231 C332(1.06); C456(0.18)  LDD2122  [5]
 LDCM0530  Nucleophilic fragment 28a MDA-MB-231 C73(0.79); C332(0.93); C456(0.64); C409(1.11)  LDD2123  [5]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C73(1.29); C332(1.07)  LDD2124  [5]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C73(0.71); C332(0.95); C409(1.04)  LDD2125  [5]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C332(1.06)  LDD2126  [5]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C73(1.02); C332(1.01); C456(0.83); C409(0.95)  LDD2127  [5]
 LDCM0535  Nucleophilic fragment 30b MDA-MB-231 C332(0.75)  LDD2128  [5]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C73(1.11); C332(0.65)  LDD2129  [5]
 LDCM0540  Nucleophilic fragment 35 MDA-MB-231 C73(0.54)  LDD2133  [5]
 LDCM0541  Nucleophilic fragment 36 MDA-MB-231 C73(0.36); C36(0.59)  LDD2134  [5]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C73(1.57); C332(2.22)  LDD2135  [5]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C73(1.20); C332(1.23); C456(0.89); C409(1.10)  LDD2136  [5]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C456(0.93)  LDD2137  [5]
 LDCM0211  Nucleophilic fragment 3b MDA-MB-231 C73(2.02); C332(1.26)  LDD1700  [5]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C73(0.65); C332(0.84); C456(0.95); C409(0.90)  LDD2140  [5]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C332(0.54)  LDD2141  [5]
 LDCM0550  Nucleophilic fragment 5a MDA-MB-231 C73(2.18); C332(2.10)  LDD2144  [5]
 LDCM0551  Nucleophilic fragment 5b MDA-MB-231 C73(2.65)  LDD2145  [5]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C73(0.96); C332(0.96)  LDD2146  [5]
 LDCM0554  Nucleophilic fragment 7a MDA-MB-231 C73(0.45)  LDD2148  [5]
 LDCM0555  Nucleophilic fragment 7b MDA-MB-231 C332(1.15); C456(0.29)  LDD2149  [5]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C456(0.43)  LDD2150  [5]
 LDCM0557  Nucleophilic fragment 8b MDA-MB-231 C332(1.47)  LDD2151  [5]
 LDCM0559  Nucleophilic fragment 9b MDA-MB-231 C73(1.41); C456(1.77)  LDD2153  [5]
 LDCM0131  RA190 MM1.R C409(1.72)  LDD0304  [32]
 LDCM0021  THZ1 HCT 116 C73(1.17)  LDD2173  [9]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Enzyme
Click To Hide/Show 3 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
E3 ubiquitin-protein ligase BRE1A (RNF20) BRE1 family Q5VTR2
E3 ubiquitin-protein ligase BRE1B (RNF40) BRE1 family O75150
Poly(A)-specific ribonuclease PARN (PARN) CAF1 family O95453
Transporter and channel
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Nuclear cap-binding protein subunit 2 (NCBP2) RRM NCBP2 family P52298
Other
Click To Hide/Show 5 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Small ribosomal subunit protein eS6 (RPS6) Eukaryotic ribosomal protein eS6 family P62753
Nuclear cap-binding protein subunit 3 (NCBP3) NCBP3 family Q53F19
Polyadenylate-binding protein 1 (PABPC1) Polyadenylate-binding protein type-1 family P11940
Polymerase delta-interacting protein 3 (POLDIP3) . Q9BY77
Proline-serine-threonine phosphatase-interacting protein 1 (PSTPIP1) . O43586

References

1 Quantitative and Site-Specific Chemoproteomic Profiling of Targets of Acrolein. Chem Res Toxicol. 2019 Mar 18;32(3):467-473. doi: 10.1021/acs.chemrestox.8b00343. Epub 2019 Jan 15.
2 Cyclopropenone, Cyclopropeniminium Ion, and Cyclopropenethione as Novel Electrophilic Warheads for Potential Target Discovery of Triple-Negative Breast Cancer. J Med Chem. 2023 Feb 23;66(4):2851-2864. doi: 10.1021/acs.jmedchem.2c01889. Epub 2023 Feb 10.
3 Chemoproteomic profiling of kinases in live cells using electrophilic sulfonyl triazole probes. Chem Sci. 2021 Jan 21;12(9):3295-3307. doi: 10.1039/d0sc06623k.
4 An Azo Coupling-Based Chemoproteomic Approach to Systematically Profile the Tyrosine Reactivity in the Human Proteome. Anal Chem. 2021 Jul 27;93(29):10334-10342. doi: 10.1021/acs.analchem.1c01935. Epub 2021 Jul 12.
5 Nucleophilic covalent ligand discovery for the cysteine redoxome. Nat Chem Biol. 2023 Nov;19(11):1309-1319. doi: 10.1038/s41589-023-01330-5. Epub 2023 May 29.
Mass spectrometry data entry: PXD039908 , PXD029761
6 Appendage and Scaffold Diverse Fully Functionalized Small-Molecule Probes via a Minimalist Terminal Alkyne-Aliphatic Diazirine Isocyanide. J Org Chem. 2018 Sep 21;83(18):11245-11253. doi: 10.1021/acs.joc.8b01831. Epub 2018 Aug 31.
7 Chemoproteomic capture of RNA binding activity in living cells. Nat Commun. 2023 Oct 7;14(1):6282. doi: 10.1038/s41467-023-41844-z.
Mass spectrometry data entry: PXD044625
8 Discovery of a Cell-Active SuTEx Ligand of Prostaglandin Reductase 2. Chembiochem. 2021 Jun 15;22(12):2134-2139. doi: 10.1002/cbic.202000879. Epub 2021 Apr 29.
9 Reimagining high-throughput profiling of reactive cysteines for cell-based screening of large electrophile libraries. Nat Biotechnol. 2021 May;39(5):630-641. doi: 10.1038/s41587-020-00778-3. Epub 2021 Jan 4.
10 Targeted Proteomic Approaches for Proteome-Wide Characterizations of the AMP-Binding Capacities of Kinases. J Proteome Res. 2022 Aug 5;21(8):2063-2070. doi: 10.1021/acs.jproteome.2c00225. Epub 2022 Jul 12.
11 Enhancing Cysteine Chemoproteomic Coverage through Systematic Assessment of Click Chemistry Product Fragmentation. Anal Chem. 2022 Mar 8;94(9):3800-3810. doi: 10.1021/acs.analchem.1c04402. Epub 2022 Feb 23.
Mass spectrometry data entry: PXD028853
12 SP3-FAIMS Chemoproteomics for High-Coverage Profiling of the Human Cysteinome*. Chembiochem. 2021 May 14;22(10):1841-1851. doi: 10.1002/cbic.202000870. Epub 2021 Feb 18.
Mass spectrometry data entry: PXD023056 , PXD023059 , PXD023058 , PXD023057 , PXD023060
13 SP3-Enabled Rapid and High Coverage Chemoproteomic Identification of Cell-State-Dependent Redox-Sensitive Cysteines. Mol Cell Proteomics. 2022 Apr;21(4):100218. doi: 10.1016/j.mcpro.2022.100218. Epub 2022 Feb 25.
Mass spectrometry data entry: PXD029500 , PXD031647
14 Comparison of Quantitative Mass Spectrometry Platforms for Monitoring Kinase ATP Probe Uptake in Lung Cancer. J Proteome Res. 2018 Jan 5;17(1):63-75. doi: 10.1021/acs.jproteome.7b00329. Epub 2017 Nov 22.
Mass spectrometry data entry: PXD006095 , PXD006096
15 N-Acryloylindole-alkyne (NAIA) enables imaging and profiling new ligandable cysteines and oxidized thiols by chemoproteomics. Nat Commun. 2023 Jun 15;14(1):3564. doi: 10.1038/s41467-023-39268-w.
Mass spectrometry data entry: PXD041264
16 Chemoproteomic Profiling by Cysteine Fluoroalkylation Reveals Myrocin G as an Inhibitor of the Nonhomologous End Joining DNA Repair Pathway. J Am Chem Soc. 2021 Dec 8;143(48):20332-20342. doi: 10.1021/jacs.1c09724. Epub 2021 Nov 24.
Mass spectrometry data entry: PXD029255
17 A modification-centric assessment tool for the performance of chemoproteomic probes. Nat Chem Biol. 2022 Aug;18(8):904-912. doi: 10.1038/s41589-022-01074-8. Epub 2022 Jul 21.
Mass spectrometry data entry: PXD027758 , PXD027755 , PXD027760 , PXD027762 , PXD027756 , PXD027591 , PXD007149 , PXD030064 , PXD032392 , PXD027789 , PXD027767 , PXD027764
18 DFT-Guided Discovery of Ethynyl-Triazolyl-Phosphinates as Modular Electrophiles for Chemoselective Cysteine Bioconjugation and Profiling. Angew Chem Int Ed Engl. 2022 Oct 10;61(41):e202205348. doi: 10.1002/anie.202205348. Epub 2022 Aug 22.
Mass spectrometry data entry: PXD033004
19 Oxidative cyclization reagents reveal tryptophan cation- interactions. Nature. 2024 Mar;627(8004):680-687. doi: 10.1038/s41586-024-07140-6. Epub 2024 Mar 6.
Mass spectrometry data entry: PXD001377 , PXD005252
20 Tunable Amine-Reactive Electrophiles for Selective Profiling of Lysine. Angew Chem Int Ed Engl. 2022 Jan 26;61(5):e202112107. doi: 10.1002/anie.202112107. Epub 2021 Dec 16.
21 ACR-Based Probe for the Quantitative Profiling of Histidine Reactivity in the Human Proteome. J Am Chem Soc. 2023 Mar 8;145(9):5252-5260. doi: 10.1021/jacs.2c12653. Epub 2023 Feb 27.
22 Oxidant-Induced Bioconjugation for Protein Labeling in Live Cells. ACS Chem Biol. 2023 Jan 20;18(1):112-122. doi: 10.1021/acschembio.2c00740. Epub 2022 Dec 21.
23 Chemoproteomic profiling of targets of lipid-derived electrophiles by bioorthogonal aminooxy probe. Redox Biol. 2017 Aug;12:712-718. doi: 10.1016/j.redox.2017.04.001. Epub 2017 Apr 5.
24 Ligand and Target Discovery by Fragment-Based Screening in Human Cells. Cell. 2017 Jan 26;168(3):527-541.e29. doi: 10.1016/j.cell.2016.12.029. Epub 2017 Jan 19.
25 Design and synthesis of minimalist terminal alkyne-containing diazirine photo-crosslinkers and their incorporation into kinase inhibitors for cell- and tissue-based proteome profiling. Angew Chem Int Ed Engl. 2013 Aug 12;52(33):8551-6. doi: 10.1002/anie.201300683. Epub 2013 Jun 10.
26 Pharmacological Targeting of Vacuolar H(+)-ATPase via Subunit V1G Combats Multidrug-Resistant Cancer. Cell Chem Biol. 2020 Nov 19;27(11):1359-1370.e8. doi: 10.1016/j.chembiol.2020.06.011. Epub 2020 Jul 9.
27 Cell-based proteome profiling of potential dasatinib targets by use of affinity-based probes. J Am Chem Soc. 2012 Feb 15;134(6):3001-14. doi: 10.1021/ja208518u. Epub 2012 Feb 1.
28 Covalent Ligand Screening Uncovers a RNF4 E3 Ligase Recruiter for Targeted Protein Degradation Applications. ACS Chem Biol. 2019 Nov 15;14(11):2430-2440. doi: 10.1021/acschembio.8b01083. Epub 2019 May 13.
29 Accelerating multiplexed profiling of protein-ligand interactions: High-throughput plate-based reactive cysteine profiling with minimal input. Cell Chem Biol. 2024 Mar 21;31(3):565-576.e4. doi: 10.1016/j.chembiol.2023.11.015. Epub 2023 Dec 19.
Mass spectrometry data entry: PXD044402
30 Site-specific quantitative cysteine profiling with data-independent acquisition-based mass spectrometry. Methods Enzymol. 2023;679:295-322. doi: 10.1016/bs.mie.2022.07.037. Epub 2022 Sep 7.
Mass spectrometry data entry: PXD027578
31 Proteome-wide covalent ligand discovery in native biological systems. Nature. 2016 Jun 23;534(7608):570-4. doi: 10.1038/nature18002. Epub 2016 Jun 15.
32 Physical and Functional Analysis of the Putative Rpn13 Inhibitor RA190. Cell Chem Biol. 2020 Nov 19;27(11):1371-1382.e6. doi: 10.1016/j.chembiol.2020.08.007. Epub 2020 Aug 27.