Details of the Target

General Information of Target

Target ID LDTP10500
Target Name Lymphokine-activated killer T-cell-originated protein kinase (PBK)
Gene Name PBK
Gene ID 55872
Synonyms
TOPK; Lymphokine-activated killer T-cell-originated protein kinase; EC 2.7.12.2; Cancer/testis antigen 84; CT84; MAPKK-like protein kinase; Nori-3; PDZ-binding kinase; Spermatogenesis-related protein kinase; SPK; T-LAK cell-originated protein kinase
3D Structure
Download
2D Sequence (FASTA)
Download
3D Structure (PDB)
Download
Sequence
MWSGRSSFTSLVVGVFVVYVVHTCWVMYGIVYTRPCSGDANCIQPYLARRPKLQLSVYTT
TRSHLGAENNIDLVLNVEDFDVESKFERTVNVSVPKKTRNNGTLYAYIFLHHAGVLPWHD
GKQVHLVSPLTTYMVPKPEEINLLTGESDTQQIEAEKKPTSALDEPVSHWRPRLALNVMA
DNFVFDGSSLPADVHRYMKMIQLGKTVHYLPILFIDQLSNRVKDLMVINRSTTELPLTVS
YDKVSLGRLRFWIHMQDAVYSLQQFGFSEKDADEVKGIFVDTNLYFLALTFFVAAFHLLF
DFLAFKNDISFWKKKKSMIGMSTKAVLWRCFSTVVIFLFLLDEQTSLLVLVPAGVGAAIE
LWKVKKALKMTIFWRGLMPEFQFGTYSESERKTEEYDTQAMKYLSYLLYPLCVGGAVYSL
LNIKYKSWYSWLINSFVNGVYAFGFLFMLPQLFVNYKLKSVAHLPWKAFTYKAFNTFIDD
VFAFIITMPTSHRLACFRDDVVFLVYLYQRWLYPVDKRRVNEFGESYEEKATRAPHTD
Target Type
Literature-reported
Target Bioclass
Enzyme
Family
Protein kinase superfamily, STE Ser/Thr protein kinase family, MAP kinase kinase subfamily
Function
Phosphorylates MAP kinase p38. Seems to be active only in mitosis. May also play a role in the activation of lymphoid cells. When phosphorylated, forms a complex with TP53, leading to TP53 destabilization and attenuation of G2/M checkpoint during doxorubicin-induced DNA damage.
TTD ID
T98642
Uniprot ID
Q96KB5
DrugMap ID
TTMY6BZ
Ensemble ID
ENST00000301905.9
HGNC ID
HGNC:18282
ChEMBL ID
CHEMBL4896

Target Site Mutations in Different Cell Lines

Cell line Mutation details Probe for labeling this protein in this cell
HEC1 SNV: p.E216Ter DBIA    Probe Info 
K562 SNV: p.K17N FFF probe13    Probe Info 

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 35 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		15.00  LDD0402  [1]
CY-1
 Probe Info  		100.00  LDD0243  [2]
TH211
 Probe Info  		Y74(5.93); Y100(20.00)  LDD0260  [3]
TH216
 Probe Info  		Y74(11.07)  LDD0259  [3]
STPyne
 Probe Info  		K161(1.03); K87(10.00); K90(7.37)  LDD0277  [4]
DA-P3
 Probe Info  		4.54  LDD0180  [5]
AHL-Pu-1
 Probe Info  		C205(20.00); C112(3.78)  LDD0168  [6]
EA-probe
 Probe Info  		C22(0.80)  LDD2210  [7]
HHS-482
 Probe Info  		Y100(0.68); Y156(1.34); Y74(0.99)  LDD0285  [8]
HHS-475
 Probe Info  		Y117(0.62); Y47(0.78); Y100(0.96); Y74(1.33)  LDD0264  [9]
HHS-465
 Probe Info  		Y100(9.66)  LDD2237  [10]
DBIA
 Probe Info  		C22(1.60); C112(1.66)  LDD0080  [11]
W1
 Probe Info  		C70(0.76)  LDD0239  [12]
5E-2FA
 Probe Info  		N.A.  LDD2235  [13]
ATP probe
 Probe Info  		K90(0.00); K64(0.00); K65(0.00); K12(0.00)  LDD0199  [14]
4-Iodoacetamidophenylacetylene
 Probe Info  		C70(0.00); C22(0.00); C300(0.00); C205(0.00)  LDD0038  [15]
IA-alkyne
 Probe Info  		C205(0.00); C185(0.00); C70(0.00); C22(0.00)  LDD0036  [15]
Lodoacetamide azide
 Probe Info  		C70(0.00); C22(0.00); C300(0.00); C205(0.00)  LDD0037  [15]
BTD
 Probe Info  		N.A.  LDD0004  [16]
JW-RF-010
 Probe Info  		C70(0.00); C22(0.00)  LDD0026  [17]
NAIA_4
 Probe Info  		C22(0.00); C70(0.00); C112(0.00); C205(0.00)  LDD2226  [18]
TFBX
 Probe Info  		C70(0.00); C22(0.00)  LDD0027  [17]
WYneN
 Probe Info  		C22(0.00); C70(0.00)  LDD0021  [16]
WYneO
 Probe Info  		N.A.  LDD0022  [16]
Compound 10
 Probe Info  		C22(0.00); C70(0.00)  LDD2216  [19]
Compound 11
 Probe Info  		C22(0.00); C70(0.00)  LDD2213  [19]
IPM
 Probe Info  		C22(0.00); C70(0.00)  LDD0005  [16]
PF-06672131
 Probe Info  		C22(0.00); C70(0.00)  LDD0017  [20]
SF
 Probe Info  		N.A.  LDD0028  [21]
VSF
 Probe Info  		C22(0.00); C70(0.00)  LDD0007  [16]
Phosphinate-6
 Probe Info  		C22(0.00); C70(0.00)  LDD0018  [22]
Acrolein
 Probe Info  		C300(0.00); C205(0.00)  LDD0217  [23]
Methacrolein
 Probe Info  		N.A.  LDD0218  [23]
AOyne
 Probe Info  		15.00  LDD0443  [24]
NAIA_5
 Probe Info  		C70(0.00); C22(0.00); C300(0.00)  LDD2223  [18]
PAL-AfBPP Probe
Click To Hide/Show 4 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
FFF probe11
 Probe Info  		7.46  LDD0472  [25]
FFF probe13
 Probe Info  		20.00  LDD0475  [25]
FFF probe14
 Probe Info  		20.00  LDD0477  [25]
FFF probe3
 Probe Info  		17.77  LDD0465  [25]

Competitor(s) Related to This Target

Competitor ID Name Cell line Binding Site(Ratio) Interaction ID Ref
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C70(1.12)  LDD2117  [26]
 LDCM0558  2-Cyano-N-phenylacetamide MDA-MB-231 C70(0.94)  LDD2152  [26]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C70(0.88)  LDD2103  [26]
 LDCM0539  3-(4-Isopropylpiperazin-1-yl)-3-oxopropanenitrile MDA-MB-231 C70(0.66)  LDD2132  [26]
 LDCM0025  4SU-RNA HEK-293T C205(20.00); C112(3.78)  LDD0168  [6]
 LDCM0026  4SU-RNA+native RNA HEK-293T C205(6.53); C70(2.76); C112(2.70)  LDD0169  [6]
 LDCM0214  AC1 HCT 116 C112(0.92); C22(0.95); C300(0.72); C70(1.01)  LDD0531  [11]
 LDCM0215  AC10 HCT 116 C112(1.14); C22(1.03); C300(0.75); C70(0.97)  LDD0532  [11]
 LDCM0216  AC100 HCT 116 C112(0.87); C22(1.01); C300(1.09); C70(1.09)  LDD0533  [11]
 LDCM0217  AC101 HCT 116 C112(0.86); C22(1.02); C300(0.92); C70(1.11)  LDD0534  [11]
 LDCM0218  AC102 HCT 116 C112(0.87); C22(1.04); C300(0.93); C70(1.10)  LDD0535  [11]
 LDCM0219  AC103 HCT 116 C112(1.23); C22(1.27); C300(0.68); C70(1.27)  LDD0536  [11]
 LDCM0220  AC104 HCT 116 C112(1.07); C22(1.11); C300(0.98); C70(1.15)  LDD0537  [11]
 LDCM0221  AC105 HCT 116 C112(1.05); C22(1.12); C300(0.84); C70(1.21)  LDD0538  [11]
 LDCM0222  AC106 HCT 116 C112(0.95); C22(1.12); C300(0.80); C70(1.30)  LDD0539  [11]
 LDCM0223  AC107 HCT 116 C112(1.09); C22(1.04); C300(0.75); C70(1.14)  LDD0540  [11]
 LDCM0224  AC108 HCT 116 C112(0.82); C22(0.85); C300(0.86); C70(0.95)  LDD0541  [11]
 LDCM0225  AC109 HCT 116 C112(0.72); C22(0.86); C300(1.00); C70(0.92)  LDD0542  [11]
 LDCM0226  AC11 HCT 116 C112(1.08); C22(1.19); C300(0.85); C70(0.96)  LDD0543  [11]
 LDCM0227  AC110 HCT 116 C112(0.80); C22(0.95); C300(0.76); C70(1.10)  LDD0544  [11]
 LDCM0228  AC111 HCT 116 C112(0.74); C22(0.96); C300(0.75); C70(1.07)  LDD0545  [11]
 LDCM0229  AC112 HCT 116 C112(0.95); C22(1.02); C300(0.71); C70(1.22)  LDD0546  [11]
 LDCM0230  AC113 HCT 116 C112(1.05); C22(0.98); C300(1.01); C70(0.92)  LDD0547  [11]
 LDCM0231  AC114 HCT 116 C112(1.18); C22(1.04); C300(0.97); C70(1.06)  LDD0548  [11]
 LDCM0232  AC115 HCT 116 C112(1.30); C22(1.07); C300(0.87); C70(1.03)  LDD0549  [11]
 LDCM0233  AC116 HCT 116 C112(1.45); C22(1.23); C300(0.84); C70(1.22)  LDD0550  [11]
 LDCM0234  AC117 HCT 116 C112(1.14); C22(0.98); C300(1.03); C70(1.12)  LDD0551  [11]
 LDCM0235  AC118 HCT 116 C112(1.07); C22(0.95); C300(0.96); C70(1.22)  LDD0552  [11]
 LDCM0236  AC119 HCT 116 C112(1.11); C22(0.98); C300(0.89); C70(1.31)  LDD0553  [11]
 LDCM0237  AC12 HCT 116 C112(0.96); C22(1.02); C300(0.92); C70(1.13)  LDD0554  [11]
 LDCM0238  AC120 HCT 116 C112(1.23); C22(1.10); C300(0.87); C70(0.94)  LDD0555  [11]
 LDCM0239  AC121 HCT 116 C112(1.14); C22(0.96); C300(1.25); C70(0.80)  LDD0556  [11]
 LDCM0240  AC122 HCT 116 C112(1.15); C22(1.00); C300(1.05); C70(1.22)  LDD0557  [11]
 LDCM0241  AC123 HCT 116 C112(0.99); C22(0.93); C300(1.10); C70(0.77)  LDD0558  [11]
 LDCM0242  AC124 HCT 116 C112(1.03); C22(0.91); C300(1.27); C70(1.02)  LDD0559  [11]
 LDCM0243  AC125 HCT 116 C112(1.16); C22(0.98); C300(1.17); C70(1.09)  LDD0560  [11]
 LDCM0244  AC126 HCT 116 C112(1.29); C22(1.12); C300(1.05); C70(1.00)  LDD0561  [11]
 LDCM0245  AC127 HCT 116 C112(1.31); C22(1.11); C300(1.00); C70(1.10)  LDD0562  [11]
 LDCM0246  AC128 HCT 116 C112(0.94); C22(1.15); C300(1.01); C70(0.65)  LDD0563  [11]
 LDCM0247  AC129 HCT 116 C112(0.95); C22(0.90); C300(1.50); C70(0.68)  LDD0564  [11]
 LDCM0249  AC130 HCT 116 C112(1.05); C22(1.02); C300(1.06); C70(0.74)  LDD0566  [11]
 LDCM0250  AC131 HCT 116 C112(1.19); C22(1.02); C300(1.24); C70(0.66)  LDD0567  [11]
 LDCM0251  AC132 HCT 116 C112(1.20); C22(0.87); C300(1.48); C70(0.76)  LDD0568  [11]
 LDCM0252  AC133 HCT 116 C112(1.13); C22(0.99); C300(1.16); C70(0.79)  LDD0569  [11]
 LDCM0253  AC134 HCT 116 C112(1.18); C22(1.03); C300(1.09); C70(0.96)  LDD0570  [11]
 LDCM0254  AC135 HCT 116 C112(1.04); C22(1.04); C300(1.14); C70(0.91)  LDD0571  [11]
 LDCM0255  AC136 HCT 116 C112(1.18); C22(1.07); C300(0.95); C70(0.81)  LDD0572  [11]
 LDCM0256  AC137 HCT 116 C112(1.35); C22(0.97); C300(1.16); C70(0.78)  LDD0573  [11]
 LDCM0257  AC138 HCT 116 C112(1.38); C22(1.04); C300(1.08); C70(0.95)  LDD0574  [11]
 LDCM0258  AC139 HCT 116 C112(1.44); C22(1.06); C300(1.18); C70(0.87)  LDD0575  [11]
 LDCM0259  AC14 HCT 116 C112(1.03); C22(1.24); C300(0.73); C70(0.92)  LDD0576  [11]
 LDCM0260  AC140 HCT 116 C112(1.53); C22(1.06); C300(1.13); C70(1.07)  LDD0577  [11]
 LDCM0261  AC141 HCT 116 C112(1.42); C22(1.09); C300(1.18); C70(0.83)  LDD0578  [11]
 LDCM0262  AC142 HCT 116 C112(1.14); C22(0.92); C300(1.03); C70(0.73)  LDD0579  [11]
 LDCM0263  AC143 HCT 116 C300(0.78); C112(1.09); C70(1.15); C22(1.19)  LDD0580  [11]
 LDCM0264  AC144 HCT 116 C300(0.56); C70(1.06); C112(1.12); C22(1.31)  LDD0581  [11]
 LDCM0265  AC145 HCT 116 C300(0.71); C112(0.99); C70(1.07); C22(1.15)  LDD0582  [11]
 LDCM0266  AC146 HCT 116 C300(0.79); C70(1.06); C112(1.12); C22(1.35)  LDD0583  [11]
 LDCM0267  AC147 HCT 116 C300(0.70); C70(0.93); C112(1.24); C22(1.30)  LDD0584  [11]
 LDCM0268  AC148 HCT 116 C300(0.44); C70(0.84); C112(1.28); C22(1.40)  LDD0585  [11]
 LDCM0269  AC149 HCT 116 C300(0.56); C70(1.18); C112(1.27); C22(1.38)  LDD0586  [11]
 LDCM0270  AC15 HCT 116 C300(0.67); C70(0.90); C112(1.04); C22(1.11)  LDD0587  [11]
 LDCM0271  AC150 HCT 116 C300(0.70); C70(1.07); C112(1.08); C22(1.17)  LDD0588  [11]
 LDCM0272  AC151 HCT 116 C300(0.73); C70(0.95); C22(1.08); C112(1.21)  LDD0589  [11]
 LDCM0273  AC152 HCT 116 C300(0.63); C112(1.10); C70(1.14); C22(1.38)  LDD0590  [11]
 LDCM0274  AC153 HCT 116 C300(0.39); C70(1.30); C112(1.45); C22(1.66)  LDD0591  [11]
 LDCM0621  AC154 HCT 116 C112(1.11); C22(1.28); C300(0.77); C70(1.00)  LDD2158  [11]
 LDCM0622  AC155 HCT 116 C112(1.19); C22(1.25); C300(0.61); C70(1.11)  LDD2159  [11]
 LDCM0623  AC156 HCT 116 C112(1.05); C22(1.14); C300(0.87); C70(1.06)  LDD2160  [11]
 LDCM0624  AC157 HCT 116 C112(1.04); C22(1.06); C300(0.83); C70(1.02)  LDD2161  [11]
 LDCM0276  AC17 HCT 116 C300(0.98); C112(1.00); C70(1.06); C22(1.10)  LDD0593  [11]
 LDCM0277  AC18 HCT 116 C300(0.74); C112(1.10); C70(1.18); C22(1.45)  LDD0594  [11]
 LDCM0278  AC19 HCT 116 C300(1.00); C70(1.06); C112(1.09); C22(1.15)  LDD0595  [11]
 LDCM0279  AC2 HCT 116 C300(0.78); C22(0.90); C112(0.96); C70(0.96)  LDD0596  [11]
 LDCM0280  AC20 HCT 116 C300(1.03); C112(1.08); C70(1.09); C22(1.12)  LDD0597  [11]
 LDCM0281  AC21 HCT 116 C300(0.95); C112(1.07); C70(1.15); C22(1.19)  LDD0598  [11]
 LDCM0282  AC22 HCT 116 C300(1.04); C70(1.06); C112(1.07); C22(1.09)  LDD0599  [11]
 LDCM0283  AC23 HCT 116 C112(0.99); C300(1.08); C22(1.09); C70(1.10)  LDD0600  [11]
 LDCM0284  AC24 HCT 116 C112(0.93); C70(0.98); C22(1.06); C300(1.19)  LDD0601  [11]
 LDCM0285  AC25 HCT 116 C112(0.92); C300(1.03); C70(1.07); C22(1.09)  LDD0602  [11]
 LDCM0286  AC26 HCT 116 C300(0.71); C112(1.00); C70(1.07); C22(1.13)  LDD0603  [11]
 LDCM0287  AC27 HCT 116 C300(0.77); C112(0.95); C70(1.23); C22(1.31)  LDD0604  [11]
 LDCM0288  AC28 HCT 116 C300(0.75); C112(1.01); C70(1.31); C22(1.33)  LDD0605  [11]
 LDCM0289  AC29 HCT 116 C300(0.68); C112(1.11); C70(1.26); C22(1.41)  LDD0606  [11]
 LDCM0290  AC3 HCT 116 C22(0.80); C300(0.81); C112(0.81); C70(0.94)  LDD0607  [11]
 LDCM0291  AC30 HCT 116 C300(0.66); C70(1.29); C112(1.32); C22(1.81)  LDD0608  [11]
 LDCM0292  AC31 HCT 116 C300(0.69); C112(0.97); C22(1.15); C70(1.17)  LDD0609  [11]
 LDCM0293  AC32 HCT 116 C300(0.63); C70(1.10); C112(1.17); C22(1.40)  LDD0610  [11]
 LDCM0294  AC33 HCT 116 C300(0.73); C112(0.94); C70(1.26); C22(1.28)  LDD0611  [11]
 LDCM0295  AC34 HCT 116 C300(0.67); C112(1.16); C70(1.40); C22(1.83)  LDD0612  [11]
 LDCM0296  AC35 HCT 116 C22(0.82); C70(0.95); C112(0.96); C300(1.13)  LDD0613  [11]
 LDCM0297  AC36 HCT 116 C22(0.81); C112(1.03); C70(1.04); C300(1.15)  LDD0614  [11]
 LDCM0298  AC37 HCT 116 C22(0.81); C70(0.84); C112(0.93); C300(1.13)  LDD0615  [11]
 LDCM0299  AC38 HCT 116 C70(0.98); C22(1.01); C112(1.02); C300(1.26)  LDD0616  [11]
 LDCM0300  AC39 HCT 116 C22(0.91); C70(0.94); C112(0.95); C300(0.98)  LDD0617  [11]
 LDCM0301  AC4 HCT 116 C300(0.83); C70(0.87); C112(0.91); C22(0.93)  LDD0618  [11]
 LDCM0302  AC40 HCT 116 C300(0.94); C112(1.00); C70(1.05); C22(1.09)  LDD0619  [11]
 LDCM0303  AC41 HCT 116 C22(0.87); C112(0.91); C70(0.96); C300(1.00)  LDD0620  [11]
 LDCM0304  AC42 HCT 116 C112(0.99); C22(1.00); C70(1.01); C300(1.05)  LDD0621  [11]
 LDCM0305  AC43 HCT 116 C70(0.91); C300(0.93); C22(0.95); C112(0.97)  LDD0622  [11]
 LDCM0306  AC44 HCT 116 C22(0.97); C70(0.98); C300(1.07); C112(1.10)  LDD0623  [11]
 LDCM0307  AC45 HCT 116 C300(0.80); C112(0.99); C22(1.13); C70(1.18)  LDD0624  [11]
 LDCM0308  AC46 HCT 116 C300(0.97); C70(0.99); C22(1.03); C112(1.12)  LDD0625  [11]
 LDCM0309  AC47 HCT 116 C22(0.98); C300(1.01); C112(1.04); C70(1.05)  LDD0626  [11]
 LDCM0310  AC48 HCT 116 C300(0.78); C70(0.88); C22(0.90); C112(1.11)  LDD0627  [11]
 LDCM0311  AC49 HCT 116 C300(0.65); C70(0.85); C22(1.17); C112(1.48)  LDD0628  [11]
 LDCM0312  AC5 HCT 116 C300(0.83); C70(0.85); C112(0.87); C22(0.94)  LDD0629  [11]
 LDCM0313  AC50 HCT 116 C300(0.75); C70(0.93); C22(1.25); C112(1.38)  LDD0630  [11]
 LDCM0314  AC51 HCT 116 C22(0.82); C70(0.84); C112(1.04); C300(1.17)  LDD0631  [11]
 LDCM0315  AC52 HCT 116 C70(0.88); C22(0.97); C300(1.02); C112(1.13)  LDD0632  [11]
 LDCM0316  AC53 HCT 116 C300(0.80); C70(1.09); C112(1.15); C22(1.20)  LDD0633  [11]
 LDCM0317  AC54 HCT 116 C300(0.79); C70(0.99); C22(1.11); C112(1.20)  LDD0634  [11]
 LDCM0318  AC55 HCT 116 C300(0.80); C70(1.15); C112(1.16); C22(1.31)  LDD0635  [11]
 LDCM0319  AC56 HCT 116 C300(0.72); C70(1.21); C112(1.41); C22(1.55)  LDD0636  [11]
 LDCM0320  AC57 HCT 116 C300(0.57); C112(0.90); C70(1.13); C22(1.20)  LDD0637  [11]
 LDCM0321  AC58 HCT 116 C300(0.47); C112(0.94); C70(1.12); C22(1.30)  LDD0638  [11]
 LDCM0322  AC59 HCT 116 C300(0.53); C112(1.03); C22(1.24); C70(1.25)  LDD0639  [11]
 LDCM0323  AC6 HCT 116 C300(0.71); C70(0.91); C112(1.14); C22(1.17)  LDD0640  [11]
 LDCM0324  AC60 HCT 116 C300(0.45); C112(1.03); C70(1.15); C22(1.29)  LDD0641  [11]
 LDCM0325  AC61 HCT 116 C300(0.39); C112(1.04); C70(1.08); C22(1.12)  LDD0642  [11]
 LDCM0326  AC62 HCT 116 C300(0.58); C112(0.99); C70(1.10); C22(1.28)  LDD0643  [11]
 LDCM0327  AC63 HCT 116 C300(0.52); C112(1.05); C22(1.18); C70(1.52)  LDD0644  [11]
 LDCM0328  AC64 HCT 116 C300(0.44); C112(1.04); C70(1.16); C22(1.32)  LDD0645  [11]
 LDCM0329  AC65 HCT 116 C300(0.56); C112(1.07); C22(1.13); C70(1.17)  LDD0646  [11]
 LDCM0330  AC66 HCT 116 C300(0.50); C70(1.03); C22(1.10); C112(1.12)  LDD0647  [11]
 LDCM0331  AC67 HCT 116 C300(0.35); C112(1.12); C22(1.14); C70(1.27)  LDD0648  [11]
 LDCM0332  AC68 HCT 116 C112(0.97); C300(1.00); C22(1.08); C70(1.23)  LDD0649  [11]
 LDCM0333  AC69 HCT 116 C300(0.95); C70(1.05); C22(1.14); C112(1.17)  LDD0650  [11]
 LDCM0334  AC7 HCT 116 C300(0.73); C112(0.99); C70(0.99); C22(1.01)  LDD0651  [11]
 LDCM0335  AC70 HCT 116 C300(0.78); C112(1.08); C22(1.17); C70(1.17)  LDD0652  [11]
 LDCM0336  AC71 HCT 116 C300(0.94); C112(0.94); C22(1.05); C70(1.09)  LDD0653  [11]
 LDCM0337  AC72 HCT 116 C300(0.91); C70(1.11); C112(1.11); C22(1.33)  LDD0654  [11]
 LDCM0338  AC73 HCT 116 C300(0.79); C70(1.29); C22(1.45); C112(1.57)  LDD0655  [11]
 LDCM0339  AC74 HCT 116 C300(0.88); C70(1.24); C22(1.43); C112(1.48)  LDD0656  [11]
 LDCM0340  AC75 HCT 116 C300(0.86); C70(1.06); C22(1.45); C112(1.58)  LDD0657  [11]
 LDCM0341  AC76 HCT 116 C300(1.00); C112(1.11); C70(1.12); C22(1.20)  LDD0658  [11]
 LDCM0342  AC77 HCT 116 C300(0.94); C70(1.02); C22(1.20); C112(1.31)  LDD0659  [11]
 LDCM0343  AC78 HCT 116 C300(0.93); C112(1.03); C22(1.14); C70(1.17)  LDD0660  [11]
 LDCM0344  AC79 HCT 116 C300(1.02); C70(1.09); C112(1.14); C22(1.17)  LDD0661  [11]
 LDCM0345  AC8 HCT 116 C300(0.71); C70(0.93); C22(1.05); C112(1.14)  LDD0662  [11]
 LDCM0346  AC80 HCT 116 C300(0.82); C70(1.01); C112(1.04); C22(1.22)  LDD0663  [11]
 LDCM0347  AC81 HCT 116 C300(0.91); C112(0.99); C22(1.06); C70(1.06)  LDD0664  [11]
 LDCM0348  AC82 HCT 116 C300(0.90); C70(0.99); C112(1.39); C22(1.43)  LDD0665  [11]
 LDCM0349  AC83 HCT 116 C300(0.71); C22(1.24); C70(1.26); C112(1.31)  LDD0666  [11]
 LDCM0350  AC84 HCT 116 C300(0.76); C22(1.19); C70(1.22); C112(1.27)  LDD0667  [11]
 LDCM0351  AC85 HCT 116 C300(0.75); C22(1.07); C112(1.15); C70(1.31)  LDD0668  [11]
 LDCM0352  AC86 HCT 116 C300(0.82); C22(1.09); C112(1.10); C70(1.14)  LDD0669  [11]
 LDCM0353  AC87 HCT 116 C22(0.92); C300(0.95); C112(1.04); C70(1.10)  LDD0670  [11]
 LDCM0354  AC88 HCT 116 C22(0.94); C300(1.01); C112(1.22); C70(1.25)  LDD0671  [11]
 LDCM0355  AC89 HCT 116 C300(0.70); C22(1.13); C112(1.16); C70(1.21)  LDD0672  [11]
 LDCM0357  AC90 HCT 116 C22(0.81); C300(0.82); C112(1.03); C70(1.13)  LDD0674  [11]
 LDCM0358  AC91 HCT 116 C300(0.84); C70(1.22); C22(1.23); C112(1.34)  LDD0675  [11]
 LDCM0359  AC92 HCT 116 C300(0.82); C22(1.17); C70(1.21); C112(1.31)  LDD0676  [11]
 LDCM0360  AC93 HCT 116 C300(0.77); C22(0.98); C112(1.14); C70(1.22)  LDD0677  [11]
 LDCM0361  AC94 HCT 116 C300(0.91); C112(0.97); C22(1.06); C70(1.12)  LDD0678  [11]
 LDCM0362  AC95 HCT 116 C22(0.96); C300(0.96); C112(1.14); C70(1.26)  LDD0679  [11]
 LDCM0363  AC96 HCT 116 C112(0.96); C300(1.00); C22(1.09); C70(1.18)  LDD0680  [11]
 LDCM0364  AC97 HCT 116 C300(0.69); C22(1.20); C112(1.27); C70(1.32)  LDD0681  [11]
 LDCM0365  AC98 HCT 116 C300(0.51); C112(1.23); C22(1.28); C70(1.34)  LDD0682  [11]
 LDCM0366  AC99 HCT 116 C300(0.65); C112(0.79); C22(1.00); C70(1.06)  LDD0683  [11]
 LDCM0248  AKOS034007472 HCT 116 C112(0.89); C22(1.04); C300(0.79); C70(0.92)  LDD0565  [11]
 LDCM0356  AKOS034007680 HCT 116 C300(0.76); C112(0.99); C70(1.00); C22(1.18)  LDD0673  [11]
 LDCM0275  AKOS034007705 HCT 116 C300(0.59); C70(0.96); C112(1.31); C22(1.39)  LDD0592  [11]
 LDCM0156  Aniline NCI-H1299 12.16  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C70(1.10); C22(1.05)  LDD2171  [11]
 LDCM0498  BS-3668 MDA-MB-231 C70(0.58)  LDD2091  [26]
 LDCM0630  CCW28-3 231MFP C22(1.49); C70(1.08)  LDD2214  [27]
 LDCM0108  Chloroacetamide HeLa N.A.  LDD0222  [23]
 LDCM0632  CL-Sc Hep-G2 C22(1.20); C70(0.99); C70(0.85)  LDD2227  [18]
 LDCM0367  CL1 HCT 116 C22(0.96); C300(0.99); C70(1.01); C112(1.12)  LDD0684  [11]
 LDCM0368  CL10 HCT 116 C300(0.71); C70(1.02); C22(1.30); C112(1.37)  LDD0685  [11]
 LDCM0369  CL100 HCT 116 C300(0.80); C112(0.89); C22(0.94); C70(1.03)  LDD0686  [11]
 LDCM0370  CL101 HCT 116 C300(0.68); C70(0.90); C112(1.07); C22(1.15)  LDD0687  [11]
 LDCM0371  CL102 HCT 116 C300(0.72); C112(0.93); C70(0.95); C22(1.13)  LDD0688  [11]
 LDCM0372  CL103 HCT 116 C70(0.89); C300(0.95); C22(0.98); C112(0.99)  LDD0689  [11]
 LDCM0373  CL104 HCT 116 C300(0.71); C70(0.91); C112(0.98); C22(1.09)  LDD0690  [11]
 LDCM0374  CL105 HCT 116 C300(0.88); C112(0.92); C70(1.06); C22(1.19)  LDD0691  [11]
 LDCM0375  CL106 HCT 116 C300(0.80); C112(0.84); C70(1.17); C22(1.40)  LDD0692  [11]
 LDCM0376  CL107 HCT 116 C300(0.83); C112(1.01); C70(1.14); C22(1.27)  LDD0693  [11]
 LDCM0377  CL108 HCT 116 C300(0.79); C112(0.88); C70(1.12); C22(1.40)  LDD0694  [11]
 LDCM0378  CL109 HCT 116 C300(0.82); C70(1.12); C112(1.16); C22(1.22)  LDD0695  [11]
 LDCM0379  CL11 HCT 116 C300(0.84); C70(1.10); C22(1.27); C112(1.36)  LDD0696  [11]
 LDCM0380  CL110 HCT 116 C112(0.87); C300(0.88); C70(1.10); C22(1.27)  LDD0697  [11]
 LDCM0381  CL111 HCT 116 C300(0.80); C70(1.12); C112(1.17); C22(1.30)  LDD0698  [11]
 LDCM0382  CL112 HCT 116 C300(0.82); C22(0.92); C112(0.93); C70(1.10)  LDD0699  [11]
 LDCM0383  CL113 HCT 116 C300(0.64); C70(1.09); C112(1.12); C22(1.27)  LDD0700  [11]
 LDCM0384  CL114 HCT 116 C300(0.66); C112(1.13); C22(1.30); C70(1.38)  LDD0701  [11]
 LDCM0385  CL115 HCT 116 C300(0.70); C112(1.18); C22(1.27); C70(1.40)  LDD0702  [11]
 LDCM0386  CL116 HCT 116 C300(0.78); C112(1.02); C22(1.15); C70(1.28)  LDD0703  [11]
 LDCM0387  CL117 HCT 116 C300(0.68); C112(0.86); C70(1.09); C22(1.44)  LDD0704  [11]
 LDCM0388  CL118 HCT 116 C112(0.94); C300(0.95); C22(0.98); C70(1.13)  LDD0705  [11]
 LDCM0389  CL119 HCT 116 C300(0.84); C112(1.01); C70(1.01); C22(1.01)  LDD0706  [11]
 LDCM0390  CL12 HCT 116 C300(0.74); C70(1.19); C22(1.40); C112(1.53)  LDD0707  [11]
 LDCM0391  CL120 HCT 116 C22(0.85); C70(0.90); C112(1.00); C300(1.02)  LDD0708  [11]
 LDCM0392  CL121 HCT 116 C300(0.72); C70(1.01); C112(1.03); C22(1.05)  LDD0709  [11]
 LDCM0393  CL122 HCT 116 C300(0.75); C70(0.93); C22(1.02); C112(1.17)  LDD0710  [11]
 LDCM0394  CL123 HCT 116 C300(0.77); C70(1.11); C22(1.12); C112(1.34)  LDD0711  [11]
 LDCM0395  CL124 HCT 116 C300(0.69); C70(1.14); C22(1.22); C112(1.28)  LDD0712  [11]
 LDCM0396  CL125 HCT 116 C300(0.91); C112(1.01); C22(1.01); C70(1.05)  LDD0713  [11]
 LDCM0397  CL126 HCT 116 C300(0.66); C112(1.00); C70(1.14); C22(1.16)  LDD0714  [11]
 LDCM0398  CL127 HCT 116 C300(0.75); C22(1.06); C112(1.09); C70(1.17)  LDD0715  [11]
 LDCM0399  CL128 HCT 116 C300(0.56); C70(0.94); C112(1.05); C22(1.17)  LDD0716  [11]
 LDCM0400  CL13 HCT 116 C300(0.77); C70(0.98); C22(1.23); C112(1.31)  LDD0717  [11]
 LDCM0401  CL14 HCT 116 C300(0.80); C70(0.98); C22(1.00); C112(1.16)  LDD0718  [11]
 LDCM0402  CL15 HCT 116 C300(0.77); C70(0.98); C22(1.18); C112(1.29)  LDD0719  [11]
 LDCM0403  CL16 HCT 116 C300(0.67); C112(1.07); C22(1.08); C70(1.09)  LDD0720  [11]
 LDCM0404  CL17 HCT 116 C300(0.66); C112(0.97); C70(0.98); C22(0.99)  LDD0721  [11]
 LDCM0405  CL18 HCT 116 C300(0.55); C112(1.04); C70(1.07); C22(1.28)  LDD0722  [11]
 LDCM0406  CL19 HCT 116 C300(0.66); C70(0.96); C112(1.05); C22(1.12)  LDD0723  [11]
 LDCM0407  CL2 HCT 116 C300(0.91); C22(0.95); C70(1.03); C112(1.09)  LDD0724  [11]
 LDCM0408  CL20 HCT 116 C300(0.72); C70(1.05); C22(1.19); C112(1.20)  LDD0725  [11]
 LDCM0409  CL21 HCT 116 C300(0.65); C70(0.92); C112(1.26); C22(1.29)  LDD0726  [11]
 LDCM0410  CL22 HCT 116 C300(0.60); C70(0.89); C22(1.48); C112(1.54)  LDD0727  [11]
 LDCM0411  CL23 HCT 116 C300(0.70); C70(1.06); C112(1.17); C22(1.18)  LDD0728  [11]
 LDCM0412  CL24 HCT 116 C300(0.58); C70(0.94); C112(1.23); C22(1.32)  LDD0729  [11]
 LDCM0413  CL25 HCT 116 C112(1.04); C22(1.26); C300(0.63); C70(0.99)  LDD0730  [11]
 LDCM0414  CL26 HCT 116 C112(1.16); C22(1.15); C300(0.69); C70(1.06)  LDD0731  [11]
 LDCM0415  CL27 HCT 116 C112(1.04); C22(1.03); C300(0.74); C70(0.85)  LDD0732  [11]
 LDCM0416  CL28 HCT 116 C112(1.10); C22(1.13); C300(0.57); C70(0.97)  LDD0733  [11]
 LDCM0417  CL29 HCT 116 C112(1.22); C22(1.19); C300(0.63); C70(0.97)  LDD0734  [11]
 LDCM0418  CL3 HCT 116 C112(1.11); C22(1.07); C300(0.84); C70(0.95)  LDD0735  [11]
 LDCM0419  CL30 HCT 116 C112(0.95); C22(1.09); C300(0.78); C70(0.96)  LDD0736  [11]
 LDCM0420  CL31 HCT 116 C112(1.22); C22(1.02); C300(0.98); C70(0.99)  LDD0737  [11]
 LDCM0421  CL32 HCT 116 C112(1.23); C22(1.06); C300(0.76); C70(1.08)  LDD0738  [11]
 LDCM0422  CL33 HCT 116 C112(1.24); C22(1.04); C300(0.68); C70(1.27)  LDD0739  [11]
 LDCM0423  CL34 HCT 116 C112(1.48); C22(1.20); C300(0.66); C70(0.94)  LDD0740  [11]
 LDCM0424  CL35 HCT 116 C112(1.62); C22(1.25); C300(0.71); C70(1.03)  LDD0741  [11]
 LDCM0425  CL36 HCT 116 C112(1.45); C22(1.25); C300(0.80); C70(1.04)  LDD0742  [11]
 LDCM0426  CL37 HCT 116 C112(1.63); C22(1.18); C300(0.73); C70(1.12)  LDD0743  [11]
 LDCM0428  CL39 HCT 116 C112(1.44); C22(1.41); C300(0.86); C70(1.15)  LDD0745  [11]
 LDCM0429  CL4 HCT 116 C112(1.03); C22(0.93); C300(0.88); C70(0.94)  LDD0746  [11]
 LDCM0430  CL40 HCT 116 C112(1.42); C22(1.40); C300(0.83); C70(1.31)  LDD0747  [11]
 LDCM0431  CL41 HCT 116 C112(1.40); C22(1.21); C300(0.88); C70(1.10)  LDD0748  [11]
 LDCM0432  CL42 HCT 116 C112(1.94); C22(1.28); C300(0.77); C70(1.08)  LDD0749  [11]
 LDCM0433  CL43 HCT 116 C112(1.56); C22(1.32); C300(0.85); C70(1.11)  LDD0750  [11]
 LDCM0434  CL44 HCT 116 C112(1.51); C22(1.06); C300(0.68); C70(1.00)  LDD0751  [11]
 LDCM0435  CL45 HCT 116 C112(1.51); C22(1.14); C300(0.71); C70(0.97)  LDD0752  [11]
 LDCM0436  CL46 HCT 116 C112(0.97); C22(0.91); C300(1.38); C70(1.11)  LDD0753  [11]
 LDCM0437  CL47 HCT 116 C112(0.96); C22(0.95); C300(1.07); C70(1.03)  LDD0754  [11]
 LDCM0438  CL48 HCT 116 C112(0.88); C22(0.94); C300(1.27); C70(1.09)  LDD0755  [11]
 LDCM0439  CL49 HCT 116 C112(1.08); C22(0.98); C300(1.24); C70(0.98)  LDD0756  [11]
 LDCM0440  CL5 HCT 116 C112(1.11); C22(1.05); C300(0.94); C70(1.02)  LDD0757  [11]
 LDCM0441  CL50 HCT 116 C112(1.09); C22(0.93); C300(1.38); C70(1.11)  LDD0758  [11]
 LDCM0442  CL51 HCT 116 C112(1.00); C22(0.93); C300(1.43); C70(1.09)  LDD0759  [11]
 LDCM0443  CL52 HCT 116 C112(1.02); C22(0.94); C300(1.32); C70(1.22)  LDD0760  [11]
 LDCM0444  CL53 HCT 116 C112(1.05); C22(1.04); C300(0.87); C70(1.15)  LDD0761  [11]
 LDCM0445  CL54 HCT 116 C112(1.07); C22(0.99); C300(1.34); C70(1.09)  LDD0762  [11]
 LDCM0446  CL55 HCT 116 C112(0.99); C22(0.90); C300(1.36); C70(1.03)  LDD0763  [11]
 LDCM0447  CL56 HCT 116 C112(1.03); C22(0.95); C300(1.08); C70(0.98)  LDD0764  [11]
 LDCM0448  CL57 HCT 116 C112(0.94); C22(0.97); C300(1.18); C70(0.92)  LDD0765  [11]
 LDCM0449  CL58 HCT 116 C112(0.99); C22(0.98); C300(1.23); C70(1.06)  LDD0766  [11]
 LDCM0450  CL59 HCT 116 C112(1.00); C22(0.95); C300(1.13); C70(1.00)  LDD0767  [11]
 LDCM0451  CL6 HCT 116 C112(1.15); C22(1.08); C300(0.63); C70(0.97)  LDD0768  [11]
 LDCM0452  CL60 HCT 116 C112(0.99); C22(1.01); C300(1.24); C70(1.02)  LDD0769  [11]
 LDCM0453  CL61 HCT 116 C112(1.09); C22(1.09); C300(0.87); C70(1.69)  LDD0770  [11]
 LDCM0454  CL62 HCT 116 C112(1.00); C22(1.06); C300(0.77); C70(1.50)  LDD0771  [11]
 LDCM0455  CL63 HCT 116 C112(1.09); C22(1.09); C300(0.83); C70(1.44)  LDD0772  [11]
 LDCM0456  CL64 HCT 116 C112(1.09); C22(1.24); C300(0.74); C70(1.34)  LDD0773  [11]
 LDCM0457  CL65 HCT 116 C112(1.05); C22(1.10); C300(0.91); C70(1.17)  LDD0774  [11]
 LDCM0458  CL66 HCT 116 C112(1.21); C22(1.34); C300(0.70); C70(1.30)  LDD0775  [11]
 LDCM0459  CL67 HCT 116 C112(1.05); C22(1.34); C300(0.84); C70(1.85)  LDD0776  [11]
 LDCM0460  CL68 HCT 116 C112(1.02); C22(1.17); C300(0.73); C70(1.36)  LDD0777  [11]
 LDCM0461  CL69 HCT 116 C112(1.22); C22(1.12); C300(0.62); C70(1.42)  LDD0778  [11]
 LDCM0462  CL7 HCT 116 C112(1.34); C22(1.31); C300(0.78); C70(1.05)  LDD0779  [11]
 LDCM0463  CL70 HCT 116 C112(1.13); C22(1.17); C300(0.70); C70(1.48)  LDD0780  [11]
 LDCM0464  CL71 HCT 116 C112(1.12); C22(1.24); C300(0.76); C70(1.48)  LDD0781  [11]
 LDCM0465  CL72 HCT 116 C112(1.01); C22(1.13); C300(0.75); C70(1.46)  LDD0782  [11]
 LDCM0466  CL73 HCT 116 C112(1.12); C22(1.38); C300(0.81); C70(1.22)  LDD0783  [11]
 LDCM0467  CL74 HCT 116 C112(1.08); C22(1.37); C300(0.83); C70(1.61)  LDD0784  [11]
 LDCM0469  CL76 HCT 116 C112(0.99); C22(1.10); C300(0.63); C70(0.91)  LDD0786  [11]
 LDCM0470  CL77 HCT 116 C112(0.99); C22(1.34); C300(0.76); C70(0.98)  LDD0787  [11]
 LDCM0471  CL78 HCT 116 C112(0.95); C22(1.11); C300(0.83); C70(1.06)  LDD0788  [11]
 LDCM0472  CL79 HCT 116 C112(1.05); C22(1.36); C300(0.64); C70(1.15)  LDD0789  [11]
 LDCM0473  CL8 HCT 116 C112(1.46); C22(1.25); C300(0.65); C70(1.38)  LDD0790  [11]
 LDCM0474  CL80 HCT 116 C112(0.97); C22(1.11); C300(0.65); C70(0.94)  LDD0791  [11]
 LDCM0475  CL81 HCT 116 C112(1.10); C22(1.15); C300(0.82); C70(1.05)  LDD0792  [11]
 LDCM0476  CL82 HCT 116 C112(1.24); C22(1.42); C300(0.49); C70(1.07)  LDD0793  [11]
 LDCM0477  CL83 HCT 116 C112(1.09); C22(1.29); C300(0.53); C70(1.14)  LDD0794  [11]
 LDCM0478  CL84 HCT 116 C112(1.31); C22(1.58); C300(0.47); C70(1.11)  LDD0795  [11]
 LDCM0479  CL85 HCT 116 C112(1.00); C22(1.04); C300(0.80); C70(0.96)  LDD0796  [11]
 LDCM0480  CL86 HCT 116 C112(0.87); C22(0.97); C300(0.86); C70(0.92)  LDD0797  [11]
 LDCM0481  CL87 HCT 116 C112(1.10); C22(1.08); C300(0.77); C70(1.05)  LDD0798  [11]
 LDCM0482  CL88 HCT 116 C112(1.08); C22(1.31); C300(0.56); C70(1.14)  LDD0799  [11]
 LDCM0483  CL89 HCT 116 C112(1.48); C22(1.72); C300(0.46); C70(1.15)  LDD0800  [11]
 LDCM0484  CL9 HCT 116 C112(1.14); C22(1.09); C300(0.81); C70(1.09)  LDD0801  [11]
 LDCM0485  CL90 HCT 116 C112(0.87); C22(0.86); C300(1.12); C70(0.91)  LDD0802  [11]
 LDCM0486  CL91 HCT 116 C112(1.00); C22(1.02); C300(0.87); C70(1.11)  LDD0803  [11]
 LDCM0487  CL92 HCT 116 C112(1.17); C22(1.01); C300(0.85); C70(1.12)  LDD0804  [11]
 LDCM0488  CL93 HCT 116 C112(1.05); C22(1.02); C300(0.96); C70(1.11)  LDD0805  [11]
 LDCM0489  CL94 HCT 116 C112(0.96); C22(1.18); C300(0.89); C70(1.04)  LDD0806  [11]
 LDCM0490  CL95 HCT 116 C112(1.02); C22(1.12); C300(0.71); C70(1.03)  LDD0807  [11]
 LDCM0491  CL96 HCT 116 C112(1.10); C22(0.95); C300(0.74); C70(0.98)  LDD0808  [11]
 LDCM0492  CL97 HCT 116 C112(1.00); C22(0.91); C300(0.69); C70(0.97)  LDD0809  [11]
 LDCM0493  CL98 HCT 116 C112(0.93); C22(0.98); C300(0.73); C70(1.14)  LDD0810  [11]
 LDCM0494  CL99 HCT 116 C112(0.89); C22(0.90); C300(0.68); C70(1.02)  LDD0811  [11]
 LDCM0634  CY-0357 Hep-G2 C112(1.05); C70(0.83); C70(0.81); C22(0.72)  LDD2228  [18]
 LDCM0028  Dobutamine HEK-293T 4.54  LDD0180  [5]
 LDCM0495  E2913 HEK-293T C70(0.94); C112(0.96); C22(1.01); C205(1.15)  LDD1698  [28]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C22(1.28); C70(1.08)  LDD1702  [26]
 LDCM0175  Ethacrynic acid HeLa C22(0.80)  LDD2210  [7]
 LDCM0625  F8 Ramos C70(1.12); C22(1.22); C112(0.56)  LDD2187  [29]
 LDCM0572  Fragment10 Ramos C70(1.75); C22(1.77)  LDD2189  [29]
 LDCM0573  Fragment11 Ramos C70(0.02); C22(0.01); C112(0.08)  LDD2190  [29]
 LDCM0574  Fragment12 Ramos C70(1.10); C22(0.90)  LDD2191  [29]
 LDCM0575  Fragment13 Ramos C70(1.01); C22(0.93)  LDD2192  [29]
 LDCM0576  Fragment14 Ramos C70(0.80); C22(0.83); C112(0.68)  LDD2193  [29]
 LDCM0579  Fragment20 Ramos C70(1.40); C22(1.28)  LDD2194  [29]
 LDCM0580  Fragment21 Ramos C70(1.06); C22(0.83)  LDD2195  [29]
 LDCM0582  Fragment23 Ramos C70(1.74); C22(0.99)  LDD2196  [29]
 LDCM0578  Fragment27 Ramos C70(0.91); C22(0.86)  LDD2197  [29]
 LDCM0586  Fragment28 Ramos C70(0.71); C22(2.59); C112(2.31)  LDD2198  [29]
 LDCM0588  Fragment30 Ramos C70(1.25); C22(1.00)  LDD2199  [29]
 LDCM0589  Fragment31 Ramos C70(1.18); C22(1.03)  LDD2200  [29]
 LDCM0590  Fragment32 Ramos C70(1.68); C22(1.10)  LDD2201  [29]
 LDCM0468  Fragment33 HCT 116 C112(1.07); C22(1.19); C300(0.76); C70(1.55)  LDD0785  [11]
 LDCM0596  Fragment38 Ramos C70(1.15); C22(0.75)  LDD2203  [29]
 LDCM0566  Fragment4 Ramos C70(0.99); C22(0.75); C112(0.42)  LDD2184  [29]
 LDCM0427  Fragment51 HCT 116 C112(1.69); C22(1.44); C300(0.91); C70(1.45)  LDD0744  [11]
 LDCM0610  Fragment52 Ramos C70(1.17); C22(1.07)  LDD2204  [29]
 LDCM0614  Fragment56 Ramos C70(1.18); C22(0.98)  LDD2205  [29]
 LDCM0569  Fragment7 Ramos C70(0.80); C22(0.75); C112(0.74)  LDD2186  [29]
 LDCM0571  Fragment9 Ramos C70(1.20); C22(1.04)  LDD2188  [29]
 LDCM0116  HHS-0101 DM93 Y117(0.62); Y47(0.78); Y100(0.96); Y74(1.33)  LDD0264  [9]
 LDCM0117  HHS-0201 DM93 Y117(0.58); Y100(0.76); Y47(0.90); Y74(2.78)  LDD0265  [9]
 LDCM0118  HHS-0301 DM93 Y117(0.48); Y47(0.70); Y100(0.81); Y74(2.75)  LDD0266  [9]
 LDCM0119  HHS-0401 DM93 Y117(0.66); Y47(0.73); Y100(0.91); Y74(1.17)  LDD0267  [9]
 LDCM0120  HHS-0701 DM93 Y117(0.66); Y100(0.79); Y47(0.87); Y74(2.36)  LDD0268  [9]
 LDCM0015  HNE MDA-MB-231 C22(1.18)  LDD0346  [29]
 LDCM0107  IAA HeLa C300(0.00); H93(0.00)  LDD0221  [23]
 LDCM0123  JWB131 DM93 Y100(0.68); Y156(1.34); Y74(0.99)  LDD0285  [8]
 LDCM0124  JWB142 DM93 Y100(0.38); Y156(0.66); Y74(0.85)  LDD0286  [8]
 LDCM0125  JWB146 DM93 Y100(1.03); Y156(1.35); Y74(1.27)  LDD0287  [8]
 LDCM0126  JWB150 DM93 Y100(3.12); Y156(6.83); Y74(2.82)  LDD0288  [8]
 LDCM0127  JWB152 DM93 Y100(1.99); Y156(5.62); Y74(1.82)  LDD0289  [8]
 LDCM0128  JWB198 DM93 Y100(1.23); Y156(2.04); Y74(1.32)  LDD0290  [8]
 LDCM0129  JWB202 DM93 Y156(0.92); Y74(0.95)  LDD0291  [8]
 LDCM0130  JWB211 DM93 Y100(1.25); Y156(1.04); Y74(0.90)  LDD0292  [8]
 LDCM0022  KB02 HCT 116 C22(1.60); C112(1.66)  LDD0080  [11]
 LDCM0023  KB03 HCT 116 C22(1.16); C112(1.17)  LDD0081  [11]
 LDCM0024  KB05 HCT 116 C22(1.75); C112(1.35)  LDD0082  [11]
 LDCM0030  Luteolin HEK-293T 11.04  LDD0182  [5]
 LDCM0109  NEM HeLa H93(0.00); C300(0.00)  LDD0223  [23]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C70(1.23)  LDD2093  [26]
 LDCM0504  Nucleophilic fragment 15a MDA-MB-231 C70(1.08)  LDD2097  [26]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C70(1.11)  LDD2099  [26]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C70(1.33)  LDD2109  [26]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C70(0.87)  LDD2111  [26]
 LDCM0527  Nucleophilic fragment 26b MDA-MB-231 C70(0.89)  LDD2120  [26]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C70(0.93)  LDD2125  [26]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C70(1.13)  LDD2127  [26]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C70(1.05)  LDD2129  [26]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C70(0.98)  LDD2136  [26]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C70(1.15)  LDD2137  [26]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C70(0.98)  LDD2140  [26]
 LDCM0549  Nucleophilic fragment 43 MDA-MB-231 C70(0.93)  LDD2143  [26]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C70(1.02)  LDD2146  [26]
 LDCM0559  Nucleophilic fragment 9b MDA-MB-231 C70(1.84)  LDD2153  [26]
 LDCM0627  NUDT7-COV-1 HEK-293T C70(0.74); C70(0.44); C22(0.11)  LDD2206  [30]
 LDCM0032  Oleacein HEK-293T 10.26  LDD0184  [5]
 LDCM0628  OTUB2-COV-1 HEK-293T C70(0.75); C70(0.73); C22(0.17)  LDD2207  [30]
 LDCM0029  Quercetin HEK-293T 7.46  LDD0181  [5]
 LDCM0131  RA190 MM1.R C70(1.93); C112(1.66); C22(1.16)  LDD0304  [31]
 LDCM0021  THZ1 HCT 116 C70(1.10); C22(1.05)  LDD2173  [11]
 LDCM0112  W16 Hep-G2 C70(0.76)  LDD0239  [12]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Enzyme
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Serine/threonine-protein kinase A-Raf (ARAF) TKL Ser/Thr protein kinase family P10398
Transporter and channel
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Cellular tumor antigen p53 (TP53) P53 family P04637
Transcription factor
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Zinc finger protein 526 (ZNF526) Krueppel C2H2-type zinc-finger protein family Q8TF50
Other
Click To Hide/Show 2 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
DNA damage-inducible transcript 4-like protein (DDIT4L) DDIT4 family Q96D03
Microspherule protein 1 (MCRS1) . Q96EZ8

The Drug(s) Related To This Target

Investigative
Click To Hide/Show 2 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Ots964 Small molecular drug D0Y2WP
Hitopk-032 . D06DPJ

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 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
5 A chemical probe unravels the reactive proteome of health-associated catechols. Chem Sci. 2023 Jul 22;14(32):8635-8643. doi: 10.1039/d3sc00888f. eCollection 2023 Aug 16.
Mass spectrometry data entry: PXD043348
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 Chemoproteomic Profiling Reveals Ethacrynic Acid Targets Adenine Nucleotide Translocases to Impair Mitochondrial Function. Mol Pharm. 2018 Jun 4;15(6):2413-2422. doi: 10.1021/acs.molpharmaceut.8b00250. Epub 2018 May 15.
8 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.
9 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.
10 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.
11 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.
12 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.
13 Global profiling of functional histidines in live cells using small-molecule photosensitizer and chemical probe relay labelling. Nat Chem. 2024 Jun 4. doi: 10.1038/s41557-024-01545-6. Online ahead of print.
Mass spectrometry data entry: PXD042377
14 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.
15 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
16 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
17 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
18 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
19 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
20 Site-Specific Activity-Based Protein Profiling Using Phosphonate Handles. Mol Cell Proteomics. 2023 Jan;22(1):100455. doi: 10.1016/j.mcpro.2022.100455. Epub 2022 Nov 24.
Mass spectrometry data entry: PXD036569
21 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
22 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
23 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.
24 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.
25 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.
26 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
27 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.
28 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
29 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
30 Rapid Covalent-Probe Discovery by Electrophile-Fragment Screening. J Am Chem Soc. 2019 Jun 5;141(22):8951-8968. doi: 10.1021/jacs.9b02822. Epub 2019 May 22.
31 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.