Details of the Target

General Information of Target

Target ID LDTP07982
Target Name Lysine-specific demethylase 3B (KDM3B)
Gene Name KDM3B
Gene ID 51780
Synonyms
C5orf7; JHDM2B; JMJD1B; KIAA1082; Lysine-specific demethylase 3B; EC 1.14.11.65; JmjC domain-containing histone demethylation protein 2B; Jumonji domain-containing protein 1B; Nuclear protein 5qNCA; [histone H3]-dimethyl-L-lysine(9) demethylase 3B
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MADAAASPVGKRLLLLFADTAASASASAPAAAAASGDPGPALRTRAWRAGTVRAMSGAVP
QDLAIFVEFDGCNWKQHSWVKVHAEEVIVLLLEGSLVWAPREDPVLLQGIRVSIAQWPAL
TFTPLVDKLGLGSVVPVEYLLDRELRFLSDANGLHLFQMGTDSQNQILLEHAALRETVNA
LISDQKLQEIFSRGPYSVQGHRVKIYQPEGEEGWLYGVVSHQDSITRLMEVSVTESGEIK
SVDPRLIHVMLMDNSAPQSEGGTLKAVKSSKGKKKRESIEGKDGRRRKSASDSGCDPASK
KLKGDRGEVDSNGSDGGEASRGPWKGGNASGEPGLDQRAKQPPSTFVPQINRNIRFATYT
KENGRTLVVQDEPVGGDTPASFTPYSTATGQTPLAPEVGGAENKEAGKTLEQVGQGIVAS
AAVVTTASSTPNTVRISDTGLAAGTVPEKQKGSRSQASGENSRNSILASSGFGAPLPSSS
QPLTFGSGRSQSNGVLATENKPLGFSFGCSSAQEAQKDTDLSKNLFFQCMSQTLPTSNYF
TTVSESLADDSSSRDSFKQSLESLSSGLCKGRSVLGTDTKPGSKAGSSVDRKVPAESMPT
LTPAFPRSLLNARTPENHENLFLQPPKLSREEPSNPFLAFVEKVEHSPFSSFASQASGSS
SSATTVTSKVAPSWPESHSSADSASLAKKKPLFITTDSSKLVSGVLGSALTSGGPSLSAM
GNGRSSSPTSSLTQPIEMPTLSSSPTEERPTVGPGQQDNPLLKTFSNVFGRHSGGFLSSP
ADFSQENKAPFEAVKRFSLDERSLACRQDSDSSTNSDLSDLSDSEEQLQAKTGLKGIPEH
LMGKLGPNGERSAELLLGKSKGKQAPKGRPRTAPLKVGQSVLKDVSKVKKLKQSGEPFLQ
DGSCINVAPHLHKCRECRLERYRKFKEQEQDDSTVACRFFHFRRLIFTRKGVLRVEGFLS
PQQSDPDAMNLWIPSSSLAEGIDLETSKYILANVGDQFCQLVMSEKEAMMMVEPHQKVAW
KRAVRGVREMCDVCETTLFNIHWVCRKCGFGVCLDCYRLRKSRPRSETEEMGDEEVFSWL
KCAKGQSHEPENLMPTQIIPGTALYNIGDMVHAARGKWGIKANCPCISRQNKSVLRPAVT
NGMSQLPSINPSASSGNETTFSGGGGPAPVTTPEPDHVPKADSTDIRSEEPLKTDSSASN
SNSELKAIRPPCPDTAPPSSALHWLADLATQKAKEETKEAGSLRSVLNKESHSPFGLDSF
NSTAKVSPLTPKLFNSLLLGPTASNNKTEGSSLRDLLHSGPGKLPQTPLDTGIPFPPVFS
TSSAGVKSKASLPNFLDHIIASVVENKKTSDASKRACNLTDTQKEVKEMVMGLNVLDPHT
SHSWLCDGRLLCLHDPSNKNNWKIFRECWKQGQPVLVSGVHKKLKSELWKPEAFSQEFGD
QDVDLVNCRNCAIISDVKVRDFWDGFEIICKRLRSEDGQPMVLKLKDWPPGEDFRDMMPT
RFEDLMENLPLPEYTKRDGRLNLASRLPSYFVRPDLGPKMYNAYGLITAEDRRVGTTNLH
LDVSDAVNVMVYVGIPIGEGAHDEEVLKTIDEGDADEVTKQRIHDGKEKPGALWHIYAAK
DAEKIRELLRKVGEEQGQENPPDHDPIHDQSWYLDQTLRKRLYEEYGVQGWAIVQFLGDA
VFIPAGAPHQVHNLYSCIKVAEDFVSPEHVKHCFRLTQEFRHLSNTHTNHEDKLQVKNII
YHAVKDAVGTLKAHESKLARS
Target Bioclass
Enzyme
Family
JHDM2 histone demethylase family
Subcellular location
Nucleus
Function
Histone demethylase that specifically demethylates 'Lys-9' of histone H3, thereby playing a central role in histone code. Demethylation of Lys residue generates formaldehyde and succinate. May have tumor suppressor activity.
Uniprot ID
Q7LBC6
Ensemble ID
ENST00000314358.10
HGNC ID
HGNC:1337
ChEMBL ID
CHEMBL3784906

Target Site Mutations in Different Cell Lines

Cell line Mutation details Probe for labeling this protein in this cell
22RV1 Insertion: p.D1643LfsTer36 .
CHL1 SNV: p.P482S DBIA    Probe Info 
HCT15 SNV: p.D1444Y .
IPC298 SNV: p.S1253L DBIA    Probe Info 
JURKAT SNV: p.M1094I; p.A1685V Compound 10    Probe Info 
K562 SNV: p.G1026C .
LNCaP clone FGC SNV: p.V1586I DBIA    Probe Info 
MCC26 SNV: p.Q207Ter; p.P636L .
MDAMB453 SNV: p.Q1000H DBIA    Probe Info 
MEWO SNV: p.L564R DBIA    Probe Info 
MFE280 SNV: p.E850Q DBIA    Probe Info 
MFE319 SNV: p.R944G DBIA    Probe Info 
NB1 SNV: p.R724H DBIA    Probe Info 
OVK18 SNV: p.G444W DBIA    Probe Info 
RT112 SNV: p.G213A .
SG231 SNV: p.Q1675H DBIA    Probe Info 
SHP77 SNV: p.V593G DBIA    Probe Info 
SNU1 SNV: p.L1293F DBIA    Probe Info 
SW480 SNV: p.Q1479K .

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 28 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		9.31  LDD0402  [1]
TH211
 Probe Info  		Y196(20.00); Y1530(15.45)  LDD0257  [2]
ONAyne
 Probe Info  		K1607(10.00)  LDD0274  [3]
BTD
 Probe Info  		C1357(1.11)  LDD1699  [4]
P11
 Probe Info  		11.60  LDD0201  [5]
AHL-Pu-1
 Probe Info  		C1212(2.12)  LDD0168  [6]
HHS-475
 Probe Info  		Y196(0.87)  LDD0264  [7]
HHS-465
 Probe Info  		Y196(4.71)  LDD2237  [8]
DBIA
 Probe Info  		C1124(1.18); C1126(1.18); C295(1.00); C569(0.98)  LDD0078  [9]
ATP probe
 Probe Info  		K1047(0.00); K1017(0.00)  LDD0199  [10]
4-Iodoacetamidophenylacetylene
 Probe Info  		C1357(0.00); C1470(0.00); C1392(0.00); C1451(0.00)  LDD0038  [11]
IA-alkyne
 Probe Info  		C1357(0.00); C1212(0.00); C1470(0.00); C937(0.00)  LDD0036  [11]
Lodoacetamide azide
 Probe Info  		C1357(0.00); C1470(0.00); C1392(0.00); C1448(0.00)  LDD0037  [11]
NAIA_4
 Probe Info  		C509(0.00); C569(0.00); C904(0.00); C1357(0.00)  LDD2226  [12]
TFBX
 Probe Info  		N.A.  LDD0027  [13]
WYneN
 Probe Info  		N.A.  LDD0021  [14]
WYneO
 Probe Info  		C569(0.00); C1357(0.00)  LDD0022  [14]
Compound 10
 Probe Info  		C1357(0.00); C1451(0.00); C509(0.00); C569(0.00)  LDD2216  [15]
Compound 11
 Probe Info  		C1357(0.00); C1451(0.00); C509(0.00); C569(0.00)  LDD2213  [15]
ENE
 Probe Info  		N.A.  LDD0006  [14]
IPM
 Probe Info  		C1126(0.00); C569(0.00); C1212(0.00)  LDD0005  [14]
SF
 Probe Info  		N.A.  LDD0028  [16]
VSF
 Probe Info  		C509(0.00); C295(0.00)  LDD0007  [14]
Phosphinate-6
 Probe Info  		C1470(0.00); C569(0.00); C1357(0.00); C1212(0.00)  LDD0018  [17]
Acrolein
 Probe Info  		N.A.  LDD0217  [18]
Methacrolein
 Probe Info  		N.A.  LDD0218  [18]
W1
 Probe Info  		C295(0.00); C937(0.00)  LDD0236  [19]
NAIA_5
 Probe Info  		C1357(0.00); C1212(0.00); C937(0.00); C1392(0.00)  LDD2223  [12]
PAL-AfBPP Probe
Click To Hide/Show 1 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
VE-P
 Probe Info  		N.A.  LDD0396  [20]

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 C1357(0.82)  LDD2142  [4]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C1357(0.90)  LDD2112  [4]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C1357(1.13)  LDD2103  [4]
 LDCM0025  4SU-RNA HEK-293T C1212(2.12)  LDD0168  [6]
 LDCM0026  4SU-RNA+native RNA HEK-293T C1212(2.21)  LDD0169  [6]
 LDCM0214  AC1 HCT 116 C1056(1.08); C1124(0.98); C1126(0.96); C1357(1.00)  LDD0531  [9]
 LDCM0215  AC10 HCT 116 C1048(1.26); C1053(1.35); C1056(1.14); C1124(0.96)  LDD0532  [9]
 LDCM0216  AC100 HCT 116 C1048(0.77); C1053(0.98); C1056(0.77); C1126(1.06)  LDD0533  [9]
 LDCM0217  AC101 HCT 116 C1048(0.52); C1053(0.90); C1056(0.52); C1126(1.13)  LDD0534  [9]
 LDCM0218  AC102 HCT 116 C1048(0.55); C1053(0.74); C1056(0.55); C1126(0.97)  LDD0535  [9]
 LDCM0219  AC103 HCT 116 C1048(0.66); C1053(0.76); C1056(0.66); C1126(1.25)  LDD0536  [9]
 LDCM0220  AC104 HCT 116 C1048(0.74); C1053(0.81); C1056(0.74); C1126(0.96)  LDD0537  [9]
 LDCM0221  AC105 HCT 116 C1048(0.51); C1053(1.07); C1056(0.51); C1126(1.04)  LDD0538  [9]
 LDCM0222  AC106 HCT 116 C1048(0.75); C1053(0.68); C1056(0.75); C1126(1.11)  LDD0539  [9]
 LDCM0223  AC107 HCT 116 C1048(0.60); C1053(0.94); C1056(0.59); C1126(1.08)  LDD0540  [9]
 LDCM0224  AC108 HCT 116 C1048(0.60); C1053(0.67); C1056(0.57); C1126(1.16)  LDD0541  [9]
 LDCM0225  AC109 HCT 116 C1048(0.63); C1053(1.46); C1056(0.61); C1126(1.23)  LDD0542  [9]
 LDCM0226  AC11 HCT 116 C1048(1.05); C1053(1.44); C1056(1.15); C1124(1.10)  LDD0543  [9]
 LDCM0227  AC110 HCT 116 C1048(0.76); C1053(0.60); C1056(0.74); C1126(0.96)  LDD0544  [9]
 LDCM0228  AC111 HCT 116 C1048(0.74); C1053(0.61); C1056(0.69); C1126(0.89)  LDD0545  [9]
 LDCM0229  AC112 HCT 116 C1048(0.73); C1053(0.70); C1056(0.71); C1126(1.01)  LDD0546  [9]
 LDCM0230  AC113 HCT 116 C1048(0.94); C1056(1.02); C1124(0.85); C1126(0.82)  LDD0547  [9]
 LDCM0231  AC114 HCT 116 C1048(1.09); C1056(1.12); C1124(0.95); C1126(1.17)  LDD0548  [9]
 LDCM0232  AC115 HCT 116 C1048(1.04); C1056(1.04); C1124(1.04); C1126(1.03)  LDD0549  [9]
 LDCM0233  AC116 HCT 116 C1048(0.98); C1056(1.24); C1124(1.06); C1126(1.14)  LDD0550  [9]
 LDCM0234  AC117 HCT 116 C1048(0.93); C1056(1.15); C1124(1.00); C1126(1.08)  LDD0551  [9]
 LDCM0235  AC118 HCT 116 C1048(1.01); C1056(1.01); C1124(0.96); C1126(0.99)  LDD0552  [9]
 LDCM0236  AC119 HCT 116 C1048(0.96); C1056(0.96); C1124(1.06); C1126(1.19)  LDD0553  [9]
 LDCM0237  AC12 HCT 116 C1048(1.02); C1053(1.45); C1056(1.12); C1124(0.97)  LDD0554  [9]
 LDCM0238  AC120 HCT 116 C1048(0.70); C1056(0.78); C1124(1.17); C1126(1.10)  LDD0555  [9]
 LDCM0239  AC121 HCT 116 C1048(1.15); C1056(1.15); C1124(0.91); C1126(0.97)  LDD0556  [9]
 LDCM0240  AC122 HCT 116 C1048(0.94); C1056(1.16); C1124(0.95); C1126(1.20)  LDD0557  [9]
 LDCM0241  AC123 HCT 116 C1048(1.00); C1056(0.91); C1124(1.23); C1126(1.22)  LDD0558  [9]
 LDCM0242  AC124 HCT 116 C1048(0.98); C1056(1.05); C1124(1.11); C1126(1.01)  LDD0559  [9]
 LDCM0243  AC125 HCT 116 C1048(1.08); C1056(1.08); C1124(0.92); C1126(0.96)  LDD0560  [9]
 LDCM0244  AC126 HCT 116 C1048(0.93); C1056(1.12); C1124(1.12); C1126(1.23)  LDD0561  [9]
 LDCM0245  AC127 HCT 116 C1048(0.96); C1056(1.12); C1124(1.12); C1126(1.13)  LDD0562  [9]
 LDCM0246  AC128 HCT 116 C1048(1.20); C1056(1.20); C1124(0.31); C1126(0.98)  LDD0563  [9]
 LDCM0247  AC129 HCT 116 C1048(0.97); C1056(0.97); C1124(0.40); C1126(0.90)  LDD0564  [9]
 LDCM0249  AC130 HCT 116 C1048(0.86); C1056(0.86); C1124(0.50); C1126(0.99)  LDD0566  [9]
 LDCM0250  AC131 HCT 116 C1048(1.07); C1056(1.07); C1124(0.38); C1126(0.96)  LDD0567  [9]
 LDCM0251  AC132 HCT 116 C1048(0.98); C1056(0.98); C1124(0.45); C1126(1.37)  LDD0568  [9]
 LDCM0252  AC133 HCT 116 C1048(0.98); C1056(0.98); C1124(0.55); C1126(0.90)  LDD0569  [9]
 LDCM0253  AC134 HCT 116 C1048(0.98); C1056(0.98); C1124(0.56); C1126(1.16)  LDD0570  [9]
 LDCM0254  AC135 HCT 116 C1048(1.26); C1056(1.26); C1124(0.69); C1126(1.01)  LDD0571  [9]
 LDCM0255  AC136 HCT 116 C1048(1.19); C1056(1.19); C1124(0.43); C1126(1.36)  LDD0572  [9]
 LDCM0256  AC137 HCT 116 C1048(1.10); C1056(1.10); C1124(0.34); C1126(0.77)  LDD0573  [9]
 LDCM0257  AC138 HCT 116 C1048(0.89); C1056(0.89); C1124(0.52); C1126(1.02)  LDD0574  [9]
 LDCM0258  AC139 HCT 116 C1048(1.22); C1056(1.22); C1124(0.53); C1126(1.01)  LDD0575  [9]
 LDCM0259  AC14 HCT 116 C1048(1.06); C1053(1.23); C1056(1.11); C1124(0.80)  LDD0576  [9]
 LDCM0260  AC140 HCT 116 C1048(0.97); C1056(0.97); C1124(0.65); C1126(1.36)  LDD0577  [9]
 LDCM0261  AC141 HCT 116 C1048(0.99); C1056(0.99); C1124(0.42); C1126(1.02)  LDD0578  [9]
 LDCM0262  AC142 HCT 116 C1048(1.11); C1056(1.11); C1124(0.50); C1126(0.74)  LDD0579  [9]
 LDCM0263  AC143 HCT 116 C937(0.88); C1053(0.93); C72(1.00); C999(1.01)  LDD0580  [9]
 LDCM0264  AC144 HCT 116 C569(0.84); C937(0.94); C1056(0.97); C1053(0.99)  LDD0581  [9]
 LDCM0265  AC145 HCT 116 C569(0.82); C937(0.91); C1053(0.99); C1056(1.04)  LDD0582  [9]
 LDCM0266  AC146 HCT 116 C569(0.73); C937(0.89); C72(0.97); C1053(1.05)  LDD0583  [9]
 LDCM0267  AC147 HCT 116 C569(0.92); C1053(1.02); C1056(1.10); C937(1.17)  LDD0584  [9]
 LDCM0268  AC148 HCT 116 C569(0.96); C1056(1.10); C1053(1.12); C72(1.27)  LDD0585  [9]
 LDCM0269  AC149 HCT 116 C937(0.84); C1053(0.91); C1056(1.03); C569(1.03)  LDD0586  [9]
 LDCM0270  AC15 HCT 116 C1357(0.80); C1126(0.85); C1124(0.89); C509(0.90)  LDD0587  [9]
 LDCM0271  AC150 HCT 116 C1053(0.88); C569(0.89); C937(0.90); C1056(0.94)  LDD0588  [9]
 LDCM0272  AC151 HCT 116 C937(0.86); C72(0.91); C1053(0.91); C569(0.92)  LDD0589  [9]
 LDCM0273  AC152 HCT 116 C1053(0.86); C1056(0.94); C569(1.00); C72(1.06)  LDD0590  [9]
 LDCM0274  AC153 HCT 116 C569(0.91); C1053(1.11); C1056(1.16); C937(1.21)  LDD0591  [9]
 LDCM0621  AC154 HCT 116 C1053(1.00); C1056(0.98); C1126(1.60); C1357(1.40)  LDD2158  [9]
 LDCM0622  AC155 HCT 116 C1053(1.00); C1056(1.03); C1126(1.65); C1357(1.37)  LDD2159  [9]
 LDCM0623  AC156 HCT 116 C1053(1.05); C1056(1.01); C1126(1.15); C1357(1.17)  LDD2160  [9]
 LDCM0624  AC157 HCT 116 C1053(1.12); C1056(1.07); C1126(0.83); C1357(1.00)  LDD2161  [9]
 LDCM0276  AC17 HCT 116 C1048(0.84); C1053(0.84); C1056(0.84); C72(0.91)  LDD0593  [9]
 LDCM0277  AC18 HCT 116 C72(0.48); C1048(0.56); C1053(0.56); C1056(0.56)  LDD0594  [9]
 LDCM0278  AC19 HCT 116 C72(0.88); C1124(0.94); C999(1.03); C1048(1.03)  LDD0595  [9]
 LDCM0279  AC2 HCT 116 C1357(0.93); C937(0.97); C1126(0.99); C509(1.02)  LDD0596  [9]
 LDCM0280  AC20 HCT 116 C1048(0.94); C1053(0.94); C1056(0.94); C1124(1.01)  LDD0597  [9]
 LDCM0281  AC21 HCT 116 C72(0.87); C1048(0.92); C1053(0.92); C1056(0.92)  LDD0598  [9]
 LDCM0282  AC22 HCT 116 C72(0.72); C937(0.77); C999(0.90); C1470(0.95)  LDD0599  [9]
 LDCM0283  AC23 HCT 116 C1124(0.84); C569(0.87); C72(0.87); C999(0.92)  LDD0600  [9]
 LDCM0284  AC24 HCT 116 C569(0.75); C72(0.90); C999(0.94); C1357(0.97)  LDD0601  [9]
 LDCM0285  AC25 HCT 116 C1392(0.82); C904(0.90); C937(0.98); C1056(0.98)  LDD0602  [9]
 LDCM0286  AC26 HCT 116 C1392(0.71); C1048(0.88); C904(0.94); C1056(0.98)  LDD0603  [9]
 LDCM0287  AC27 HCT 116 C1048(0.89); C1392(0.89); C904(0.91); C937(1.01)  LDD0604  [9]
 LDCM0288  AC28 HCT 116 C1392(0.68); C1048(0.83); C904(0.90); C1053(0.94)  LDD0605  [9]
 LDCM0289  AC29 HCT 116 C1392(0.63); C1048(0.79); C937(0.86); C904(0.87)  LDD0606  [9]
 LDCM0290  AC3 HCT 116 C295(0.80); C1124(0.86); C509(0.91); C1357(0.93)  LDD0607  [9]
 LDCM0291  AC30 HCT 116 C1392(0.65); C1048(0.76); C904(0.81); C1056(0.99)  LDD0608  [9]
 LDCM0292  AC31 HCT 116 C1392(0.65); C1048(0.82); C904(0.89); C937(0.94)  LDD0609  [9]
 LDCM0293  AC32 HCT 116 C1392(0.68); C1048(0.77); C904(0.87); C1053(1.03)  LDD0610  [9]
 LDCM0294  AC33 HCT 116 C1392(0.69); C904(0.96); C72(1.02); C1048(1.06)  LDD0611  [9]
 LDCM0295  AC34 HCT 116 C1392(0.64); C1048(0.72); C1053(0.83); C1056(0.84)  LDD0612  [9]
 LDCM0296  AC35 HCT 116 C1048(0.49); C1056(0.63); C1392(0.65); C937(0.81)  LDD0613  [9]
 LDCM0297  AC36 HCT 116 C1048(0.77); C937(0.82); C999(0.85); C904(0.91)  LDD0614  [9]
 LDCM0298  AC37 HCT 116 C1048(0.64); C904(0.81); C937(0.89); C999(0.89)  LDD0615  [9]
 LDCM0299  AC38 HCT 116 C1048(0.69); C937(0.81); C1392(0.87); C1056(0.94)  LDD0616  [9]
 LDCM0300  AC39 HCT 116 C937(0.75); C1048(0.80); C1056(0.84); C1053(0.92)  LDD0617  [9]
 LDCM0301  AC4 HCT 116 C295(0.76); C1124(0.79); C509(0.90); C937(0.90)  LDD0618  [9]
 LDCM0302  AC40 HCT 116 C937(0.73); C1056(0.78); C904(0.95); C1048(0.97)  LDD0619  [9]
 LDCM0303  AC41 HCT 116 C1392(0.70); C1048(0.74); C937(0.78); C999(0.82)  LDD0620  [9]
 LDCM0304  AC42 HCT 116 C937(0.82); C1392(0.83); C1056(0.84); C904(0.91)  LDD0621  [9]
 LDCM0305  AC43 HCT 116 C1048(0.80); C1392(0.83); C1056(0.88); C904(0.90)  LDD0622  [9]
 LDCM0306  AC44 HCT 116 C1392(0.74); C937(0.79); C1056(0.86); C1048(0.90)  LDD0623  [9]
 LDCM0307  AC45 HCT 116 C1392(0.77); C1056(0.79); C1048(0.85); C937(0.93)  LDD0624  [9]
 LDCM0308  AC46 HCT 116 C1392(0.79); C904(0.90); C1048(0.91); C1451(1.03)  LDD0625  [9]
 LDCM0309  AC47 HCT 116 C1392(0.87); C904(0.93); C937(0.94); C1048(0.95)  LDD0626  [9]
 LDCM0310  AC48 HCT 116 C904(0.75); C1048(0.92); C999(0.96); C1392(1.04)  LDD0627  [9]
 LDCM0311  AC49 HCT 116 C1048(0.84); C904(0.95); C1392(0.97); C937(1.09)  LDD0628  [9]
 LDCM0312  AC5 HCT 116 C1124(0.72); C295(0.78); C509(0.82); C1126(0.84)  LDD0629  [9]
 LDCM0313  AC50 HCT 116 C1048(0.92); C1392(0.96); C904(1.05); C937(1.08)  LDD0630  [9]
 LDCM0314  AC51 HCT 116 C999(0.85); C1451(0.90); C904(0.92); C1048(0.92)  LDD0631  [9]
 LDCM0315  AC52 HCT 116 C1048(0.82); C1392(0.88); C904(0.91); C999(0.97)  LDD0632  [9]
 LDCM0316  AC53 HCT 116 C1048(0.90); C1392(0.93); C904(0.94); C937(0.95)  LDD0633  [9]
 LDCM0317  AC54 HCT 116 C1048(0.84); C1392(0.89); C1451(1.02); C904(1.05)  LDD0634  [9]
 LDCM0318  AC55 HCT 116 C1392(0.84); C904(0.99); C1048(1.10); C937(1.17)  LDD0635  [9]
 LDCM0319  AC56 HCT 116 C1048(0.77); C904(1.14); C1392(1.15); C937(1.21)  LDD0636  [9]
 LDCM0320  AC57 HCT 116 C1053(0.85); C904(0.87); C1392(0.91); C937(0.97)  LDD0637  [9]
 LDCM0321  AC58 HCT 116 C904(0.83); C1392(0.88); C1053(0.94); C1126(0.96)  LDD0638  [9]
 LDCM0322  AC59 HCT 116 C904(0.81); C1392(0.91); C937(0.99); C1056(1.07)  LDD0639  [9]
 LDCM0323  AC6 HCT 116 C1048(1.00); C1126(1.03); C937(1.04); C904(1.05)  LDD0640  [9]
 LDCM0324  AC60 HCT 116 C904(0.69); C1053(0.88); C937(0.89); C1392(0.93)  LDD0641  [9]
 LDCM0325  AC61 HCT 116 C904(0.62); C937(0.84); C1053(0.87); C1056(1.01)  LDD0642  [9]
 LDCM0326  AC62 HCT 116 C904(0.79); C1392(0.85); C937(0.90); C1056(1.13)  LDD0643  [9]
 LDCM0327  AC63 HCT 116 C904(0.71); C937(0.84); C1392(0.86); C1053(0.96)  LDD0644  [9]
 LDCM0328  AC64 HCT 116 C904(0.86); C1392(0.92); C937(1.01); C1048(1.03)  LDD0645  [9]
 LDCM0329  AC65 HCT 116 C904(0.52); C569(0.72); C509(0.87); C1392(1.02)  LDD0646  [9]
 LDCM0330  AC66 HCT 116 C904(0.51); C569(0.73); C509(0.77); C1053(0.93)  LDD0647  [9]
 LDCM0331  AC67 HCT 116 C904(0.54); C569(0.78); C1053(0.88); C509(0.90)  LDD0648  [9]
 LDCM0332  AC68 HCT 116 C72(0.96); C1451(1.03); C904(1.05); C509(1.05)  LDD0649  [9]
 LDCM0333  AC69 HCT 116 C509(0.92); C1451(1.01); C937(1.04); C904(1.10)  LDD0650  [9]
 LDCM0334  AC7 HCT 116 C1124(0.85); C904(0.88); C937(0.90); C569(0.93)  LDD0651  [9]
 LDCM0335  AC70 HCT 116 C509(0.62); C1126(0.86); C295(0.95); C937(0.95)  LDD0652  [9]
 LDCM0336  AC71 HCT 116 C295(0.75); C509(0.83); C72(0.86); C1357(1.06)  LDD0653  [9]
 LDCM0337  AC72 HCT 116 C509(0.66); C72(0.87); C904(1.13); C1451(1.13)  LDD0654  [9]
 LDCM0338  AC73 HCT 116 C509(0.78); C937(1.11); C1056(1.31); C1451(1.33)  LDD0655  [9]
 LDCM0339  AC74 HCT 116 C509(0.83); C937(0.99); C1048(1.24); C1053(1.24)  LDD0656  [9]
 LDCM0340  AC75 HCT 116 C509(0.74); C937(1.02); C72(1.26); C1451(1.33)  LDD0657  [9]
 LDCM0341  AC76 HCT 116 C509(0.80); C937(1.06); C1451(1.19); C904(1.23)  LDD0658  [9]
 LDCM0342  AC77 HCT 116 C937(0.91); C509(1.11); C904(1.15); C1451(1.18)  LDD0659  [9]
 LDCM0343  AC78 HCT 116 C937(0.97); C72(0.98); C509(1.00); C1451(1.03)  LDD0660  [9]
 LDCM0344  AC79 HCT 116 C509(0.76); C937(0.89); C295(1.05); C1048(1.06)  LDD0661  [9]
 LDCM0345  AC8 HCT 116 C1048(0.90); C1124(0.90); C1126(0.92); C1056(0.94)  LDD0662  [9]
 LDCM0346  AC80 HCT 116 C509(0.84); C1056(1.03); C1048(1.06); C1053(1.06)  LDD0663  [9]
 LDCM0347  AC81 HCT 116 C509(0.79); C1048(0.79); C1053(0.79); C72(0.83)  LDD0664  [9]
 LDCM0348  AC82 HCT 116 C509(0.65); C937(0.98); C1048(1.03); C1053(1.03)  LDD0665  [9]
 LDCM0349  AC83 HCT 116 C1048(0.90); C1056(0.93); C904(1.14); C937(1.14)  LDD0666  [9]
 LDCM0350  AC84 HCT 116 C1056(0.91); C1048(0.97); C904(1.06); C509(1.23)  LDD0667  [9]
 LDCM0351  AC85 HCT 116 C1048(0.80); C904(0.88); C1056(0.91); C509(0.96)  LDD0668  [9]
 LDCM0352  AC86 HCT 116 C569(0.92); C1126(0.94); C904(0.95); C1048(0.97)  LDD0669  [9]
 LDCM0353  AC87 HCT 116 C1056(0.91); C509(0.94); C904(0.96); C1048(0.97)  LDD0670  [9]
 LDCM0354  AC88 HCT 116 C904(0.88); C1048(0.92); C1056(0.94); C509(1.09)  LDD0671  [9]
 LDCM0355  AC89 HCT 116 C1056(0.93); C904(0.95); C1126(1.16); C937(1.19)  LDD0672  [9]
 LDCM0357  AC90 HCT 116 C509(0.67); C569(0.76); C1126(0.90); C295(0.90)  LDD0674  [9]
 LDCM0358  AC91 HCT 116 C1048(0.98); C1056(1.00); C904(1.11); C1126(1.36)  LDD0675  [9]
 LDCM0359  AC92 HCT 116 C1048(0.90); C1056(0.94); C904(1.02); C1126(1.27)  LDD0676  [9]
 LDCM0360  AC93 HCT 116 C1048(0.86); C1056(0.87); C904(0.93); C1451(1.04)  LDD0677  [9]
 LDCM0361  AC94 HCT 116 C1126(0.77); C1056(0.88); C1048(0.89); C904(0.99)  LDD0678  [9]
 LDCM0362  AC95 HCT 116 C1126(0.90); C904(0.99); C1048(1.01); C1056(1.02)  LDD0679  [9]
 LDCM0363  AC96 HCT 116 C1126(0.80); C904(0.95); C1056(1.01); C1048(1.01)  LDD0680  [9]
 LDCM0364  AC97 HCT 116 C1056(0.93); C937(0.98); C1048(1.01); C904(1.03)  LDD0681  [9]
 LDCM0365  AC98 HCT 116 C1048(0.69); C1056(0.69); C904(0.76); C1053(0.94)  LDD0682  [9]
 LDCM0366  AC99 HCT 116 C569(0.62); C1048(0.67); C1056(0.67); C904(0.76)  LDD0683  [9]
 LDCM0545  Acetamide MDA-MB-231 C1357(0.73)  LDD2138  [4]
 LDCM0248  AKOS034007472 HCT 116 C1048(1.11); C1053(1.29); C1056(1.18); C1124(1.03)  LDD0565  [9]
 LDCM0356  AKOS034007680 HCT 116 C1357(0.90); C904(0.95); C1126(1.00); C937(1.03)  LDD0673  [9]
 LDCM0275  AKOS034007705 HCT 116 C509(0.92); C1126(0.93); C1124(0.95); C904(1.04)  LDD0592  [9]
 LDCM0156  Aniline NCI-H1299 11.66  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C1124(1.18); C1126(1.18); C295(1.00); C569(0.98)  LDD0078  [9]
 LDCM0088  C45 HEK-293T 11.60  LDD0201  [5]
 LDCM0108  Chloroacetamide HeLa N.A.  LDD0222  [18]
 LDCM0632  CL-Sc Hep-G2 C295(20.00); C295(2.54); C1357(1.61); C1470(0.86)  LDD2227  [12]
 LDCM0367  CL1 HCT 116 C569(0.76); C1048(0.76); C1056(0.80); C72(0.84)  LDD0684  [9]
 LDCM0368  CL10 HCT 116 C72(0.78); C1124(0.92); C999(1.01); C1056(1.11)  LDD0685  [9]
 LDCM0369  CL100 HCT 116 C937(0.93); C904(0.94); C1126(0.95); C1357(0.98)  LDD0686  [9]
 LDCM0370  CL101 HCT 116 C1126(0.79); C1357(0.84); C1124(0.85); C904(0.98)  LDD0687  [9]
 LDCM0371  CL102 HCT 116 C1126(0.81); C904(0.84); C937(0.89); C1124(0.94)  LDD0688  [9]
 LDCM0372  CL103 HCT 116 C1357(0.83); C1126(0.91); C569(0.92); C1124(0.97)  LDD0689  [9]
 LDCM0373  CL104 HCT 116 C1357(0.88); C1126(0.95); C72(0.99); C904(1.01)  LDD0690  [9]
 LDCM0374  CL105 HCT 116 C72(0.71); C1048(0.73); C1053(0.73); C1056(0.73)  LDD0691  [9]
 LDCM0375  CL106 HCT 116 C72(0.56); C1048(0.75); C1053(0.75); C1056(0.75)  LDD0692  [9]
 LDCM0376  CL107 HCT 116 C72(0.51); C1048(0.71); C1053(0.71); C1056(0.71)  LDD0693  [9]
 LDCM0377  CL108 HCT 116 C72(0.42); C1048(0.66); C1053(0.66); C1056(0.66)  LDD0694  [9]
 LDCM0378  CL109 HCT 116 C72(0.69); C1048(0.88); C1053(0.88); C1056(0.88)  LDD0695  [9]
 LDCM0379  CL11 HCT 116 C72(0.88); C1048(0.90); C1056(0.91); C1126(1.04)  LDD0696  [9]
 LDCM0380  CL110 HCT 116 C72(0.57); C937(0.69); C1048(0.76); C1053(0.76)  LDD0697  [9]
 LDCM0381  CL111 HCT 116 C1048(0.64); C1053(0.64); C1056(0.64); C72(0.79)  LDD0698  [9]
 LDCM0382  CL112 HCT 116 C1392(0.68); C1048(0.87); C999(0.94); C1124(0.99)  LDD0699  [9]
 LDCM0383  CL113 HCT 116 C1392(0.66); C1048(0.69); C904(0.83); C1053(0.91)  LDD0700  [9]
 LDCM0384  CL114 HCT 116 C1392(0.56); C1048(0.77); C904(0.84); C1056(0.89)  LDD0701  [9]
 LDCM0385  CL115 HCT 116 C1392(0.68); C1048(0.74); C1056(0.83); C937(0.96)  LDD0702  [9]
 LDCM0386  CL116 HCT 116 C1392(0.80); C1048(0.84); C904(0.95); C1053(0.98)  LDD0703  [9]
 LDCM0387  CL117 HCT 116 C937(0.73); C1048(0.76); C1056(0.80); C1392(0.93)  LDD0704  [9]
 LDCM0388  CL118 HCT 116 C937(0.87); C1056(0.88); C1392(0.89); C1053(0.94)  LDD0705  [9]
 LDCM0389  CL119 HCT 116 C1048(0.68); C1392(0.84); C1056(0.87); C904(0.97)  LDD0706  [9]
 LDCM0390  CL12 HCT 116 C1056(0.89); C1048(0.93); C72(0.94); C999(1.19)  LDD0707  [9]
 LDCM0391  CL120 HCT 116 C1048(0.69); C1392(0.81); C904(0.83); C937(0.86)  LDD0708  [9]
 LDCM0392  CL121 HCT 116 C1126(0.56); C72(0.69); C904(0.73); C1392(0.81)  LDD0709  [9]
 LDCM0393  CL122 HCT 116 C904(0.80); C937(0.85); C1392(0.96); C1048(0.98)  LDD0710  [9]
 LDCM0394  CL123 HCT 116 C1048(0.63); C1392(0.85); C904(0.97); C937(1.00)  LDD0711  [9]
 LDCM0395  CL124 HCT 116 C1048(0.82); C904(0.97); C1392(1.09); C937(1.10)  LDD0712  [9]
 LDCM0396  CL125 HCT 116 C904(0.78); C569(0.93); C1392(0.95); C1470(0.95)  LDD0713  [9]
 LDCM0397  CL126 HCT 116 C569(0.72); C937(0.78); C904(0.87); C1470(1.01)  LDD0714  [9]
 LDCM0398  CL127 HCT 116 C904(0.67); C937(0.84); C569(0.91); C1053(0.92)  LDD0715  [9]
 LDCM0399  CL128 HCT 116 C904(0.74); C1392(0.87); C937(0.89); C1126(0.95)  LDD0716  [9]
 LDCM0400  CL13 HCT 116 C72(0.88); C1124(0.89); C1056(0.95); C1048(1.03)  LDD0717  [9]
 LDCM0401  CL14 HCT 116 C1124(0.81); C72(0.86); C999(0.89); C1357(1.06)  LDD0718  [9]
 LDCM0402  CL15 HCT 116 C72(0.74); C1048(0.83); C1056(0.83); C1124(0.92)  LDD0719  [9]
 LDCM0403  CL16 HCT 116 C937(0.76); C295(0.89); C509(0.91); C904(0.92)  LDD0720  [9]
 LDCM0404  CL17 HCT 116 C509(0.69); C72(0.76); C937(0.78); C1126(0.80)  LDD0721  [9]
 LDCM0405  CL18 HCT 116 C937(0.69); C509(0.72); C72(0.75); C904(0.93)  LDD0722  [9]
 LDCM0406  CL19 HCT 116 C937(0.74); C509(0.81); C1357(0.98); C1451(0.98)  LDD0723  [9]
 LDCM0407  CL2 HCT 116 C569(0.77); C72(0.79); C999(0.81); C1048(0.92)  LDD0724  [9]
 LDCM0408  CL20 HCT 116 C937(0.76); C509(0.87); C904(0.93); C1451(0.95)  LDD0725  [9]
 LDCM0409  CL21 HCT 116 C509(0.78); C1451(0.83); C904(0.96); C937(0.97)  LDD0726  [9]
 LDCM0410  CL22 HCT 116 C937(0.77); C1451(0.90); C509(1.01); C904(1.22)  LDD0727  [9]
 LDCM0411  CL23 HCT 116 C937(0.63); C509(0.95); C1126(0.96); C1357(1.01)  LDD0728  [9]
 LDCM0412  CL24 HCT 116 C509(0.74); C937(0.84); C904(0.97); C1357(1.13)  LDD0729  [9]
 LDCM0413  CL25 HCT 116 C1048(1.51); C1053(1.36); C1056(1.51); C1124(1.25)  LDD0730  [9]
 LDCM0414  CL26 HCT 116 C1048(1.20); C1053(1.24); C1056(1.20); C1124(1.12)  LDD0731  [9]
 LDCM0415  CL27 HCT 116 C1048(1.95); C1053(1.26); C1056(1.95); C1124(1.43)  LDD0732  [9]
 LDCM0416  CL28 HCT 116 C1048(1.14); C1053(1.29); C1056(1.14); C1124(1.22)  LDD0733  [9]
 LDCM0417  CL29 HCT 116 C1048(1.26); C1053(1.29); C1056(1.26); C1124(1.25)  LDD0734  [9]
 LDCM0418  CL3 HCT 116 C1048(0.93); C1056(0.92); C1124(1.02); C1126(1.31)  LDD0735  [9]
 LDCM0419  CL30 HCT 116 C1048(1.23); C1053(1.23); C1056(1.23); C1124(0.94)  LDD0736  [9]
 LDCM0420  CL31 HCT 116 C1124(0.85); C1126(1.14); C1357(1.24); C1392(0.93)  LDD0737  [9]
 LDCM0421  CL32 HCT 116 C1124(1.36); C1126(1.07); C1357(1.37); C1392(1.00)  LDD0738  [9]
 LDCM0422  CL33 HCT 116 C1124(1.17); C1126(1.43); C1357(1.50); C1392(0.95)  LDD0739  [9]
 LDCM0423  CL34 HCT 116 C1124(1.19); C1126(1.02); C1357(1.32); C1392(0.87)  LDD0740  [9]
 LDCM0424  CL35 HCT 116 C1124(1.36); C1126(1.07); C1357(1.21); C1392(0.87)  LDD0741  [9]
 LDCM0425  CL36 HCT 116 C1124(0.89); C1126(0.92); C1357(1.43); C1392(0.73)  LDD0742  [9]
 LDCM0426  CL37 HCT 116 C1124(1.03); C1126(1.03); C1357(1.63); C1392(0.95)  LDD0743  [9]
 LDCM0428  CL39 HCT 116 C1124(1.10); C1126(0.78); C1357(1.69); C1392(1.01)  LDD0745  [9]
 LDCM0429  CL4 HCT 116 C1048(0.82); C1056(0.83); C1124(1.03); C1126(1.01)  LDD0746  [9]
 LDCM0430  CL40 HCT 116 C1124(1.08); C1126(1.00); C1357(1.79); C1392(0.65)  LDD0747  [9]
 LDCM0431  CL41 HCT 116 C1124(1.23); C1126(0.61); C1357(1.46); C1392(1.09)  LDD0748  [9]
 LDCM0432  CL42 HCT 116 C1124(0.94); C1126(1.03); C1357(2.27); C1392(0.86)  LDD0749  [9]
 LDCM0433  CL43 HCT 116 C1124(1.14); C1126(0.76); C1357(1.50); C1392(1.07)  LDD0750  [9]
 LDCM0434  CL44 HCT 116 C1124(1.77); C1126(0.71); C1357(1.43); C1392(1.07)  LDD0751  [9]
 LDCM0435  CL45 HCT 116 C1124(1.19); C1126(0.81); C1357(1.74); C1392(0.78)  LDD0752  [9]
 LDCM0436  CL46 HCT 116 C1048(0.95); C1056(0.91); C1124(1.13); C1126(1.13)  LDD0753  [9]
 LDCM0437  CL47 HCT 116 C1048(0.92); C1056(0.86); C1124(1.18); C1126(1.18)  LDD0754  [9]
 LDCM0438  CL48 HCT 116 C1048(0.85); C1056(0.89); C1124(1.17); C1126(1.17)  LDD0755  [9]
 LDCM0439  CL49 HCT 116 C1048(1.08); C1056(1.10); C1124(0.97); C1126(0.97)  LDD0756  [9]
 LDCM0440  CL5 HCT 116 C1048(1.15); C1056(1.03); C1124(0.97); C1126(1.10)  LDD0757  [9]
 LDCM0441  CL50 HCT 116 C1048(0.94); C1056(1.01); C1124(1.07); C1126(1.07)  LDD0758  [9]
 LDCM0442  CL51 HCT 116 C1048(1.14); C1056(1.15); C1124(1.20); C1126(1.20)  LDD0759  [9]
 LDCM0443  CL52 HCT 116 C1048(0.91); C1056(0.89); C1124(1.31); C1126(1.31)  LDD0760  [9]
 LDCM0444  CL53 HCT 116 C1048(0.88); C1056(0.82); C1124(1.16); C1126(1.16)  LDD0761  [9]
 LDCM0445  CL54 HCT 116 C1048(0.95); C1056(0.91); C1124(1.04); C1126(1.04)  LDD0762  [9]
 LDCM0446  CL55 HCT 116 C1048(1.03); C1056(1.04); C1124(1.19); C1126(1.19)  LDD0763  [9]
 LDCM0447  CL56 HCT 116 C1048(0.99); C1056(0.95); C1124(1.09); C1126(1.09)  LDD0764  [9]
 LDCM0448  CL57 HCT 116 C1048(1.11); C1056(1.01); C1124(1.03); C1126(1.03)  LDD0765  [9]
 LDCM0449  CL58 HCT 116 C1048(1.07); C1056(0.98); C1124(1.11); C1126(1.11)  LDD0766  [9]
 LDCM0450  CL59 HCT 116 C1048(1.06); C1056(1.22); C1124(1.05); C1126(1.05)  LDD0767  [9]
 LDCM0451  CL6 HCT 116 C1048(1.11); C1056(1.05); C1124(1.00); C1126(1.04)  LDD0768  [9]
 LDCM0452  CL60 HCT 116 C1048(1.00); C1056(1.03); C1124(1.12); C1126(1.12)  LDD0769  [9]
 LDCM0453  CL61 HCT 116 C1048(2.02); C1124(0.93); C1126(0.93); C1357(1.12)  LDD0770  [9]
 LDCM0454  CL62 HCT 116 C1048(1.04); C1124(0.98); C1126(0.98); C1357(1.20)  LDD0771  [9]
 LDCM0455  CL63 HCT 116 C1048(0.72); C1124(1.06); C1126(1.06); C1357(1.27)  LDD0772  [9]
 LDCM0456  CL64 HCT 116 C1048(1.03); C1124(0.95); C1126(0.95); C1357(1.47)  LDD0773  [9]
 LDCM0457  CL65 HCT 116 C1048(0.88); C1124(0.87); C1126(0.87); C1357(1.20)  LDD0774  [9]
 LDCM0458  CL66 HCT 116 C1048(0.92); C1124(0.92); C1126(0.92); C1357(1.55)  LDD0775  [9]
 LDCM0459  CL67 HCT 116 C1048(0.97); C1124(0.86); C1126(0.86); C1357(1.25)  LDD0776  [9]
 LDCM0460  CL68 HCT 116 C1048(1.46); C1124(0.87); C1126(0.87); C1357(1.19)  LDD0777  [9]
 LDCM0461  CL69 HCT 116 C1048(1.03); C1124(1.06); C1126(1.06); C1357(1.25)  LDD0778  [9]
 LDCM0462  CL7 HCT 116 C1048(1.11); C1056(1.07); C1124(0.89); C1126(1.17)  LDD0779  [9]
 LDCM0463  CL70 HCT 116 C1048(0.78); C1124(0.91); C1126(0.91); C1357(1.23)  LDD0780  [9]
 LDCM0464  CL71 HCT 116 C1048(0.78); C1124(0.89); C1126(0.89); C1357(1.32)  LDD0781  [9]
 LDCM0465  CL72 HCT 116 C1048(1.15); C1124(0.89); C1126(0.89); C1357(1.08)  LDD0782  [9]
 LDCM0466  CL73 HCT 116 C1048(0.94); C1124(0.91); C1126(0.91); C1357(1.22)  LDD0783  [9]
 LDCM0467  CL74 HCT 116 C1048(1.48); C1124(0.96); C1126(0.96); C1357(1.28)  LDD0784  [9]
 LDCM0469  CL76 HCT 116 C1048(0.71); C1053(0.76); C1056(0.71); C1124(1.01)  LDD0786  [9]
 LDCM0470  CL77 HCT 116 C1048(0.73); C1053(0.72); C1056(0.73); C1124(1.03)  LDD0787  [9]
 LDCM0471  CL78 HCT 116 C1048(0.91); C1053(0.88); C1056(0.91); C1124(0.98)  LDD0788  [9]
 LDCM0472  CL79 HCT 116 C1048(0.87); C1053(0.92); C1056(0.87); C1124(1.04)  LDD0789  [9]
 LDCM0473  CL8 HCT 116 C1048(0.91); C1056(0.88); C1124(0.91); C1126(0.96)  LDD0790  [9]
 LDCM0474  CL80 HCT 116 C1048(0.79); C1053(0.72); C1056(0.79); C1124(1.07)  LDD0791  [9]
 LDCM0475  CL81 HCT 116 C1048(0.90); C1053(0.97); C1056(0.90); C1124(0.92)  LDD0792  [9]
 LDCM0476  CL82 HCT 116 C1048(0.99); C1053(1.00); C1056(0.99); C1124(0.91)  LDD0793  [9]
 LDCM0477  CL83 HCT 116 C1048(0.74); C1053(0.74); C1056(0.74); C1124(1.21)  LDD0794  [9]
 LDCM0478  CL84 HCT 116 C1048(0.84); C1053(0.89); C1056(0.84); C1124(1.14)  LDD0795  [9]
 LDCM0479  CL85 HCT 116 C1048(0.82); C1053(0.77); C1056(0.82); C1124(1.11)  LDD0796  [9]
 LDCM0480  CL86 HCT 116 C1048(0.76); C1053(0.80); C1056(0.76); C1124(1.13)  LDD0797  [9]
 LDCM0481  CL87 HCT 116 C1048(0.75); C1053(0.78); C1056(0.75); C1124(1.05)  LDD0798  [9]
 LDCM0482  CL88 HCT 116 C1048(0.88); C1053(0.74); C1056(0.88); C1124(0.85)  LDD0799  [9]
 LDCM0483  CL89 HCT 116 C1048(0.83); C1053(0.89); C1056(0.83); C1124(0.90)  LDD0800  [9]
 LDCM0484  CL9 HCT 116 C1048(0.96); C1056(0.90); C1124(0.92); C1126(1.08)  LDD0801  [9]
 LDCM0485  CL90 HCT 116 C1048(0.67); C1053(0.66); C1056(0.67); C1124(0.99)  LDD0802  [9]
 LDCM0486  CL91 HCT 116 C1056(0.91); C1124(1.05); C1126(0.99); C1357(1.01)  LDD0803  [9]
 LDCM0487  CL92 HCT 116 C1056(0.79); C1124(1.12); C1126(0.89); C1357(1.16)  LDD0804  [9]
 LDCM0488  CL93 HCT 116 C1056(1.17); C1124(0.97); C1126(1.04); C1357(0.94)  LDD0805  [9]
 LDCM0489  CL94 HCT 116 C1056(1.26); C1124(0.88); C1126(0.98); C1357(1.14)  LDD0806  [9]
 LDCM0490  CL95 HCT 116 C1056(1.06); C1124(0.97); C1126(1.03); C1357(1.38)  LDD0807  [9]
 LDCM0491  CL96 HCT 116 C1056(1.17); C1124(1.09); C1126(1.09); C1357(1.09)  LDD0808  [9]
 LDCM0492  CL97 HCT 116 C1056(1.31); C1124(1.00); C1126(0.90); C1357(0.97)  LDD0809  [9]
 LDCM0493  CL98 HCT 116 C1056(1.00); C1124(0.95); C1126(0.91); C1357(1.12)  LDD0810  [9]
 LDCM0494  CL99 HCT 116 C1056(1.16); C1124(0.84); C1126(1.09); C1357(1.02)  LDD0811  [9]
 LDCM0634  CY-0357 Hep-G2 C569(0.45)  LDD2228  [12]
 LDCM0495  E2913 HEK-293T C295(0.94); C1357(0.82); C1392(1.05); C904(0.97)  LDD1698  [21]
 LDCM0625  F8 Ramos C1357(1.19); C569(0.53); C1212(0.84)  LDD2187  [22]
 LDCM0572  Fragment10 Ramos C1357(1.82); C1451(2.14); C1212(1.12)  LDD2189  [22]
 LDCM0573  Fragment11 Ramos C1357(1.22)  LDD2190  [22]
 LDCM0574  Fragment12 Ramos C1357(0.82); 1.27; C569(1.07); C1212(0.58)  LDD2191  [22]
 LDCM0575  Fragment13 Ramos C1357(0.89); 0.99; C1451(1.19); C569(0.79)  LDD2192  [22]
 LDCM0576  Fragment14 Ramos C1357(0.89); 0.96; C1451(0.81); C1212(0.65)  LDD2193  [22]
 LDCM0579  Fragment20 Ramos C1357(1.00); 0.64; C1212(0.72)  LDD2194  [22]
 LDCM0580  Fragment21 Ramos C1357(0.69); 0.62; C1451(1.28); C1212(0.59)  LDD2195  [22]
 LDCM0582  Fragment23 Ramos C1357(0.79); 0.81; C569(1.40); C1212(1.18)  LDD2196  [22]
 LDCM0578  Fragment27 Ramos C1357(0.73); 0.82; C1212(0.81)  LDD2197  [22]
 LDCM0586  Fragment28 Ramos C1357(1.94); 0.74; C1451(0.76); C569(1.08)  LDD2198  [22]
 LDCM0588  Fragment30 Ramos C1357(0.98); 0.93; C569(1.24); C1212(0.67)  LDD2199  [22]
 LDCM0589  Fragment31 Ramos C1357(0.75); 0.82; C1212(0.70)  LDD2200  [22]
 LDCM0590  Fragment32 Ramos C1357(1.55); 1.00  LDD2201  [22]
 LDCM0468  Fragment33 HCT 116 C1048(1.49); C1124(0.87); C1126(0.87); C1357(1.23)  LDD0785  [9]
 LDCM0596  Fragment38 Ramos C1357(0.85); 0.38; C1451(2.40); C1212(2.08)  LDD2203  [22]
 LDCM0566  Fragment4 Ramos C1357(1.07); 1.30; C1212(0.81)  LDD2184  [22]
 LDCM0427  Fragment51 HCT 116 C1124(0.91); C1126(1.02); C1357(1.61); C1392(0.54)  LDD0744  [9]
 LDCM0610  Fragment52 Ramos C1357(0.89)  LDD2204  [22]
 LDCM0614  Fragment56 Ramos C1357(1.15); C1451(1.26); C1212(0.68)  LDD2205  [22]
 LDCM0569  Fragment7 Ramos C1357(1.11); C1212(1.15)  LDD2186  [22]
 LDCM0571  Fragment9 Ramos C1357(1.13); C1212(0.57)  LDD2188  [22]
 LDCM0116  HHS-0101 DM93 Y196(0.87)  LDD0264  [7]
 LDCM0117  HHS-0201 DM93 Y196(0.76)  LDD0265  [7]
 LDCM0118  HHS-0301 DM93 Y196(0.97)  LDD0266  [7]
 LDCM0119  HHS-0401 DM93 Y196(0.84)  LDD0267  [7]
 LDCM0120  HHS-0701 DM93 Y196(1.13)  LDD0268  [7]
 LDCM0022  KB02 HCT 116 C1034(2.57); C1045(2.57); C569(2.36); C1357(3.07)  LDD0080  [9]
 LDCM0023  KB03 HCT 116 C1034(4.81); C1045(4.81); C569(1.82); C1357(2.10)  LDD0081  [9]
 LDCM0024  KB05 HCT 116 C1034(3.32); C1045(3.32); C569(3.12); C1357(2.80)  LDD0082  [9]
 LDCM0509  N-(4-bromo-3,5-dimethylphenyl)-2-nitroacetamide MDA-MB-231 C1357(1.15)  LDD2102  [4]
 LDCM0528  N-(4-bromophenyl)-2-cyano-N-phenylacetamide MDA-MB-231 C1357(0.59)  LDD2121  [4]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C1357(0.76)  LDD2089  [4]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C1357(1.00)  LDD2092  [4]
 LDCM0501  Nucleophilic fragment 13b MDA-MB-231 C1357(1.58)  LDD2094  [4]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C1357(0.64)  LDD2096  [4]
 LDCM0505  Nucleophilic fragment 15b MDA-MB-231 C1357(1.41)  LDD2098  [4]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C1357(0.48)  LDD2099  [4]
 LDCM0507  Nucleophilic fragment 16b MDA-MB-231 C1357(0.88)  LDD2100  [4]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C1357(0.90)  LDD2104  [4]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C1357(1.93)  LDD2105  [4]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C1357(0.72)  LDD2107  [4]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C1392(1.02)  LDD2109  [4]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C1357(0.79)  LDD2114  [4]
 LDCM0523  Nucleophilic fragment 24b MDA-MB-231 C1357(0.96)  LDD2116  [4]
 LDCM0527  Nucleophilic fragment 26b MDA-MB-231 C1357(0.97); C1392(0.35)  LDD2120  [4]
 LDCM0529  Nucleophilic fragment 27b MDA-MB-231 C1357(1.09)  LDD2122  [4]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C1357(1.04)  LDD2124  [4]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C1357(1.10)  LDD2126  [4]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C1392(1.21)  LDD2127  [4]
 LDCM0535  Nucleophilic fragment 30b MDA-MB-231 C1357(0.87)  LDD2128  [4]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C1357(1.07)  LDD2136  [4]
 LDCM0211  Nucleophilic fragment 3b MDA-MB-231 C1357(1.06)  LDD1700  [4]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C1357(0.47)  LDD2140  [4]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C1357(0.60)  LDD2141  [4]
 LDCM0549  Nucleophilic fragment 43 MDA-MB-231 C1357(1.25); C1124(1.32)  LDD2143  [4]
 LDCM0551  Nucleophilic fragment 5b MDA-MB-231 C1357(2.84)  LDD2145  [4]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C1357(0.81)  LDD2146  [4]
 LDCM0553  Nucleophilic fragment 6b MDA-MB-231 C1357(1.56); C1392(0.39)  LDD2147  [4]
 LDCM0555  Nucleophilic fragment 7b MDA-MB-231 C1357(0.83)  LDD2149  [4]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C1357(0.36)  LDD2150  [4]
 LDCM0021  THZ1 HCT 116 C295(1.39); C1470(1.12); C569(1.10); C1357(1.05)  LDD2173  [9]

References

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2 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.
3 A Paal-Knorr agent for chemoproteomic profiling of targets of isoketals in cells. Chem Sci. 2021 Oct 15;12(43):14557-14563. doi: 10.1039/d1sc02230j. eCollection 2021 Nov 10.
Mass spectrometry data entry: PXD028270
4 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
5 Discovery of Potent and Selective Inhibitors against Protein-Derived Electrophilic Cofactors. J Am Chem Soc. 2022 Mar 30;144(12):5377-5388. doi: 10.1021/jacs.1c12748. Epub 2022 Mar 2.
6 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
7 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.
8 Global targeting of functional tyrosines using sulfur-triazole exchange chemistry. Nat Chem Biol. 2020 Feb;16(2):150-159. doi: 10.1038/s41589-019-0404-5. Epub 2019 Nov 25.
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 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
13 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
14 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
15 Multiplexed CuAAC Suzuki-Miyaura Labeling for Tandem Activity-Based Chemoproteomic Profiling. Anal Chem. 2021 Feb 2;93(4):2610-2618. doi: 10.1021/acs.analchem.0c04726. Epub 2021 Jan 20.
Mass spectrometry data entry: PXD022279
16 Solid Phase Synthesis of Fluorosulfate Containing Macrocycles for Chemoproteomic Workflows. bioRxiv [Preprint]. 2023 Feb 18:2023.02.17.529022. doi: 10.1101/2023.02.17.529022.
Mass spectrometry data entry: PXD039931
17 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
18 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.
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Mass spectrometry data entry: PXD044402
22 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