Details of the Target

General Information of Target

Target ID LDTP13824
Target Name Voltage-dependent anion-selective channel protein 3 (VDAC3)
Gene Name VDAC3
Gene ID 7419
Synonyms
Voltage-dependent anion-selective channel protein 3; VDAC-3; hVDAC3; Outer mitochondrial membrane protein porin 3
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MPLSDFILALKDNPYFGAGFGLVGVGTALALARKGVQLGLVAFRRHYMITLEVPARDRSY
AWLLSWLTRHSTRTQHLSVETSYLQHESGRISTKFEFVPSPGNHFIWYRGKWIRVERSRE
MQMIDLQTGTPWESVTFTALGTDRKVFFNILEEARELALQQEEGKTVMYTAVGSEWRPFG
YPRRRRPLNSVVLQQGLADRIVRDVQEFIDNPKWYTDRGIPYRRGYLLYGPPGCGKSSFI
TALAGELEHSICLLSLTDSSLSDDRLNHLLSVAPQQSLVLLEDVDAAFLSRDLAVENPVK
YQGLGRLTFSGLLNALDGVASTEARIVFMTTNHVDRLDPALIRPGRVDLKEYVGYCSHWQ
LTQMFQRFYPGQAPSLAENFAEHVLRATNQISPAQVQGYFMLYKNDPVGAIHNAESLRR
Target Type
Clinical trial
Target Bioclass
Transporter and channel
Family
Eukaryotic mitochondrial porin family
Subcellular location
Mitochondrion outer membrane
Function Forms a channel through the mitochondrial outer membrane that allows diffusion of small hydrophilic molecules. Involved in male fertility and sperm mitochondrial sheath formation.
TTD ID
T64774
Uniprot ID
Q9Y277
DrugMap ID
TTT48SQ
Ensemble ID
ENST00000022615.9
HGNC ID
HGNC:12674
ChEMBL ID
CHEMBL4523505

Target Site Mutations in Different Cell Lines

Cell line Mutation details Probe for labeling this protein in this cell
CAL120 SNV: p.G191R DBIA    Probe Info 
HEC1 SNV: p.R252Ter DBIA    Probe Info 
HEC1B SNV: p.R252Ter IA-alkyne    Probe Info 
IGROV1 SNV: p.Y247H .
NUGC3 SNV: p.L164P .
SKMEL2 SNV: p.G148W .
TE11 SNV: p.K12R .

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 58 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		15.00  LDD0402  [1]
Alkylaryl probe 3
 Probe Info  		7.30  LDD0381  [2]
HDSF-alk
 Probe Info  		1.82  LDD0197  [3]
FBPP2
 Probe Info  		2.32  LDD0318  [4]
CHEMBL5175495
 Probe Info  		14.13  LDD0196  [5]
W1
 Probe Info  		46.96  LDD0235  [6]
TH211
 Probe Info  		Y225(20.00); Y67(10.34)  LDD0260  [7]
FBP2
 Probe Info  		2.17  LDD0317  [4]
TH214
 Probe Info  		Y67(8.68)  LDD0258  [7]
TH216
 Probe Info  		Y67(20.00); Y173(13.39)  LDD0259  [7]
YN-1
 Probe Info  		100.00  LDD0444  [8]
YN-4
 Probe Info  		100.00  LDD0445  [8]
ONAyne
 Probe Info  		K15(0.60)  LDD0274  [9]
P11
 Probe Info  		5.23  LDD0201  [10]
JZ128-DTB
 Probe Info  		N.A.  LDD0462  [11]
BTD
 Probe Info  		C229(1.92)  LDD1700  [12]
Sulforaphane-probe2
 Probe Info  		2.34  LDD0160  [13]
Curcusone 37
 Probe Info  		3.03  LDD0188  [14]
Jackson_14
 Probe Info  		8.33  LDD0123  [15]
DA-P3
 Probe Info  		4.00  LDD0180  [16]
AHL-Pu-1
 Probe Info  		C229(2.70)  LDD0170  [17]
HPAP
 Probe Info  		6.51  LDD0062  [18]
Alkyne-RA190
 Probe Info  		2.06  LDD0299  [19]
EA-probe
 Probe Info  		N.A.  LDD0440  [20]
DBIA
 Probe Info  		C65(2.02)  LDD0080  [21]
5E-2FA
 Probe Info  		H183(0.00); H46(0.00)  LDD2235  [22]
ATP probe
 Probe Info  		N.A.  LDD0199  [23]
4-Iodoacetamidophenylacetylene
 Probe Info  		C36(0.00); C65(0.00)  LDD0038  [24]
IA-alkyne
 Probe Info  		C65(0.00); C36(0.00); C229(0.00)  LDD0032  [25]
IPIAA_L
 Probe Info  		N.A.  LDD0031  [26]
Lodoacetamide azide
 Probe Info  		C36(0.00); C65(0.00)  LDD0037  [24]
JW-RF-010
 Probe Info  		C229(0.00); C36(0.00); C65(0.00)  LDD0026  [27]
NAIA_4
 Probe Info  		C36(0.00); C65(0.00)  LDD2226  [28]
TFBX
 Probe Info  		C229(0.00); C65(0.00); C36(0.00)  LDD0027  [27]
WYneN
 Probe Info  		C229(0.00); C65(0.00); C36(0.00)  LDD0021  [29]
WYneO
 Probe Info  		C36(0.00); C65(0.00); C229(0.00)  LDD0022  [29]
aHNE
 Probe Info  		N.A.  LDD0001  [29]
Compound 10
 Probe Info  		C229(0.00); C36(0.00); C65(0.00)  LDD2216  [30]
Compound 11
 Probe Info  		C36(0.00); C65(0.00)  LDD2213  [30]
ENE
 Probe Info  		C65(0.00); C229(0.00); C36(0.00)  LDD0006  [29]
IPM
 Probe Info  		C65(0.00); C229(0.00); C36(0.00)  LDD0005  [29]
NHS
 Probe Info  		K236(0.00); K109(0.00); K61(0.00); K20(0.00)  LDD0010  [29]
PF-06672131
 Probe Info  		C2(0.00); C8(0.00); C65(0.00)  LDD0017  [31]
PPMS
 Probe Info  		N.A.  LDD0008  [29]
SF
 Probe Info  		N.A.  LDD0028  [32]
STPyne
 Probe Info  		K63(0.00); K109(0.00)  LDD0009  [29]
VSF
 Probe Info  		C65(0.00); C8(0.00); C36(0.00); C229(0.00)  LDD0007  [29]
Phosphinate-6
 Probe Info  		C229(0.00); C36(0.00); C65(0.00)  LDD0018  [33]
1c-yne
 Probe Info  		K174(0.00); K236(0.00); K90(0.00); K256(0.00)  LDD0228  [34]
Acrolein
 Probe Info  		C36(0.00); H183(0.00); C229(0.00); H46(0.00)  LDD0217  [35]
Cinnamaldehyde
 Probe Info  		C36(0.00); C229(0.00)  LDD0220  [35]
Crotonaldehyde
 Probe Info  		C36(0.00); C65(0.00); C2(0.00); C229(0.00)  LDD0219  [35]
Methacrolein
 Probe Info  		C36(0.00); C65(0.00); C2(0.00); C8(0.00)  LDD0218  [35]
AOyne
 Probe Info  		15.00  LDD0443  [36]
MPP-AC
 Probe Info  		N.A.  LDD0428  [37]
NAIA_5
 Probe Info  		C36(0.00); C65(0.00)  LDD2223  [28]
TER-AC
 Probe Info  		N.A.  LDD0426  [37]
TPP-AC
 Probe Info  		N.A.  LDD0427  [37]
PAL-AfBPP Probe
Click To Hide/Show 107 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
DR-1
 Probe Info  		2.59  LDD0398  [38]
IMP2070
 Probe Info  		1.94  LDD0367  [39]
C022
 Probe Info  		13.64  LDD1728  [40]
C040
 Probe Info  		15.03  LDD1740  [40]
C041
 Probe Info  		5.74  LDD1741  [40]
C049
 Probe Info  		6.23  LDD1747  [40]
C055
 Probe Info  		17.88  LDD1752  [40]
C056
 Probe Info  		31.78  LDD1753  [40]
C063
 Probe Info  		13.09  LDD1760  [40]
C070
 Probe Info  		10.63  LDD1766  [40]
C091
 Probe Info  		30.91  LDD1782  [40]
C092
 Probe Info  		55.33  LDD1783  [40]
C094
 Probe Info  		56.10  LDD1785  [40]
C095
 Probe Info  		5.24  LDD1786  [40]
C100
 Probe Info  		4.99  LDD1789  [40]
C106
 Probe Info  		26.72  LDD1793  [40]
C108
 Probe Info  		8.63  LDD1795  [40]
C112
 Probe Info  		35.02  LDD1799  [40]
C134
 Probe Info  		48.17  LDD1816  [40]
C135
 Probe Info  		13.09  LDD1817  [40]
C139
 Probe Info  		11.16  LDD1821  [40]
C141
 Probe Info  		10.70  LDD1823  [40]
C143
 Probe Info  		22.16  LDD1825  [40]
C153
 Probe Info  		23.26  LDD1834  [40]
C159
 Probe Info  		9.71  LDD1839  [40]
C160
 Probe Info  		9.06  LDD1840  [40]
C161
 Probe Info  		18.90  LDD1841  [40]
C163
 Probe Info  		7.73  LDD1843  [40]
C165
 Probe Info  		13.83  LDD1845  [40]
C169
 Probe Info  		35.51  LDD1849  [40]
C178
 Probe Info  		22.32  LDD1857  [40]
C186
 Probe Info  		9.06  LDD1864  [40]
C187
 Probe Info  		16.45  LDD1865  [40]
C194
 Probe Info  		8.94  LDD1870  [40]
C196
 Probe Info  		12.64  LDD1872  [40]
C198
 Probe Info  		11.16  LDD1874  [40]
C201
 Probe Info  		70.52  LDD1877  [40]
C206
 Probe Info  		22.16  LDD1881  [40]
C210
 Probe Info  		67.18  LDD1884  [40]
C218
 Probe Info  		22.78  LDD1892  [40]
C220
 Probe Info  		24.25  LDD1894  [40]
C225
 Probe Info  		5.46  LDD1898  [40]
C228
 Probe Info  		39.67  LDD1901  [40]
C231
 Probe Info  		30.06  LDD1904  [40]
C232
 Probe Info  		48.84  LDD1905  [40]
C233
 Probe Info  		9.19  LDD1906  [40]
C235
 Probe Info  		35.02  LDD1908  [40]
C238
 Probe Info  		15.14  LDD1911  [40]
C240
 Probe Info  		9.45  LDD1913  [40]
C243
 Probe Info  		15.89  LDD1916  [40]
C246
 Probe Info  		24.42  LDD1919  [40]
C252
 Probe Info  		8.57  LDD1925  [40]
C264
 Probe Info  		21.26  LDD1935  [40]
C265
 Probe Info  		14.03  LDD1936  [40]
C266
 Probe Info  		7.57  LDD1937  [40]
C270
 Probe Info  		6.11  LDD1940  [40]
C275
 Probe Info  		12.04  LDD1945  [40]
C277
 Probe Info  		11.39  LDD1947  [40]
C278
 Probe Info  		71.51  LDD1948  [40]
C285
 Probe Info  		38.85  LDD1955  [40]
C287
 Probe Info  		14.32  LDD1957  [40]
C288
 Probe Info  		6.36  LDD1958  [40]
C289
 Probe Info  		72.00  LDD1959  [40]
C293
 Probe Info  		32.00  LDD1963  [40]
C296
 Probe Info  		15.78  LDD1966  [40]
C299
 Probe Info  		6.68  LDD1968  [40]
C310
 Probe Info  		11.47  LDD1977  [40]
C314
 Probe Info  		15.24  LDD1981  [40]
C322
 Probe Info  		6.02  LDD1988  [40]
C339
 Probe Info  		5.98  LDD2002  [40]
C343
 Probe Info  		17.51  LDD2005  [40]
C349
 Probe Info  		17.15  LDD2010  [40]
C350
 Probe Info  		47.18  LDD2011  [40]
C355
 Probe Info  		36.00  LDD2016  [40]
C356
 Probe Info  		8.40  LDD2017  [40]
C362
 Probe Info  		99.73  LDD2023  [40]
C363
 Probe Info  		21.41  LDD2024  [40]
C364
 Probe Info  		31.78  LDD2025  [40]
C366
 Probe Info  		10.27  LDD2027  [40]
C367
 Probe Info  		6.82  LDD2028  [40]
C376
 Probe Info  		8.28  LDD2036  [40]
C382
 Probe Info  		10.70  LDD2041  [40]
C388
 Probe Info  		95.67  LDD2047  [40]
C390
 Probe Info  		99.73  LDD2049  [40]
C403
 Probe Info  		22.63  LDD2061  [40]
C407
 Probe Info  		20.68  LDD2064  [40]
C413
 Probe Info  		15.24  LDD2069  [40]
C424
 Probe Info  		7.67  LDD2079  [40]
C426
 Probe Info  		12.64  LDD2081  [40]
C429
 Probe Info  		17.03  LDD2084  [40]
C431
 Probe Info  		24.25  LDD2086  [40]
FFF probe11
 Probe Info  		20.00  LDD0471  [41]
FFF probe13
 Probe Info  		20.00  LDD0475  [41]
FFF probe14
 Probe Info  		20.00  LDD0477  [41]
FFF probe15
 Probe Info  		6.29  LDD0478  [41]
FFF probe2
 Probe Info  		20.00  LDD0463  [41]
FFF probe3
 Probe Info  		20.00  LDD0464  [41]
FFF probe4
 Probe Info  		16.79  LDD0466  [41]
FFF probe6
 Probe Info  		5.12  LDD0467  [41]
FFF probe7
 Probe Info  		8.76  LDD0483  [41]
FFF probe9
 Probe Info  		9.32  LDD0470  [41]
JN0003
 Probe Info  		20.00  LDD0469  [41]
BD-F
 Probe Info  		G38(0.00); C36(0.00); V39(0.00); S35(0.00)  LDD0024  [42]
LD-F
 Probe Info  		S35(0.00); C36(0.00); S37(0.00); G38(0.00)  LDD0015  [42]
DA-2
 Probe Info  		N.A.  LDD0070  [43]
OEA-DA
 Probe Info  		6.91  LDD0046  [44]
STS-1
 Probe Info  		N.A.  LDD0069  [45]

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 C36(0.97)  LDD2142  [12]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C36(1.07)  LDD2112  [12]
 LDCM0502  1-(Cyanoacetyl)piperidine MDA-MB-231 C36(0.45)  LDD2095  [12]
 LDCM0537  2-Cyano-N,N-dimethylacetamide MDA-MB-231 C36(0.61); C229(1.00)  LDD2130  [12]
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C36(1.05); C229(0.81)  LDD2117  [12]
 LDCM0558  2-Cyano-N-phenylacetamide MDA-MB-231 C36(1.41); C229(1.07)  LDD2152  [12]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C65(1.18)  LDD2103  [12]
 LDCM0538  4-(Cyanoacetyl)morpholine MDA-MB-231 C36(0.49)  LDD2131  [12]
 LDCM0025  4SU-RNA DM93 C229(2.70)  LDD0170  [17]
 LDCM0026  4SU-RNA+native RNA DM93 C36(4.05); C229(2.82)  LDD0171  [17]
 LDCM0214  AC1 HCT 116 C229(1.09); C36(3.59); C65(1.36)  LDD0531  [21]
 LDCM0215  AC10 HCT 116 C229(1.16); C65(1.20)  LDD0532  [21]
 LDCM0216  AC100 HCT 116 C36(1.01); C65(1.18)  LDD0533  [21]
 LDCM0217  AC101 HCT 116 C36(1.03); C65(1.02)  LDD0534  [21]
 LDCM0218  AC102 HCT 116 C36(1.39); C65(1.02)  LDD0535  [21]
 LDCM0219  AC103 HCT 116 C36(1.34); C65(1.37)  LDD0536  [21]
 LDCM0220  AC104 HCT 116 C36(1.73); C65(1.19)  LDD0537  [21]
 LDCM0221  AC105 HCT 116 C36(1.07); C65(1.21)  LDD0538  [21]
 LDCM0222  AC106 HCT 116 C36(1.04); C65(1.30)  LDD0539  [21]
 LDCM0223  AC107 HCT 116 C36(1.06); C65(1.27)  LDD0540  [21]
 LDCM0224  AC108 HCT 116 C36(1.25); C65(1.05)  LDD0541  [21]
 LDCM0225  AC109 HCT 116 C36(1.22); C65(0.86)  LDD0542  [21]
 LDCM0226  AC11 HCT 116 C229(1.00); C65(1.38)  LDD0543  [21]
 LDCM0227  AC110 HCT 116 C36(1.33); C65(1.01)  LDD0544  [21]
 LDCM0228  AC111 HCT 116 C36(1.25); C65(1.02)  LDD0545  [21]
 LDCM0229  AC112 HCT 116 C36(1.26); C65(1.16)  LDD0546  [21]
 LDCM0230  AC113 HCT 116 C36(0.82); C65(1.23)  LDD0547  [21]
 LDCM0231  AC114 HCT 116 C36(0.95); C65(1.30)  LDD0548  [21]
 LDCM0232  AC115 HCT 116 C36(1.18); C65(1.46)  LDD0549  [21]
 LDCM0233  AC116 HCT 116 C36(1.39); C65(1.35)  LDD0550  [21]
 LDCM0234  AC117 HCT 116 C36(1.01); C65(1.25)  LDD0551  [21]
 LDCM0235  AC118 HCT 116 C36(0.91); C65(1.08)  LDD0552  [21]
 LDCM0236  AC119 HCT 116 C36(1.04); C65(1.21)  LDD0553  [21]
 LDCM0237  AC12 HCT 116 C229(1.19); C65(1.24)  LDD0554  [21]
 LDCM0238  AC120 HCT 116 C36(2.34); C65(1.38)  LDD0555  [21]
 LDCM0239  AC121 HCT 116 C36(0.88); C65(1.42)  LDD0556  [21]
 LDCM0240  AC122 HCT 116 C36(0.87); C65(1.21)  LDD0557  [21]
 LDCM0241  AC123 HCT 116 C36(0.98); C65(1.36)  LDD0558  [21]
 LDCM0242  AC124 HCT 116 C36(0.84); C65(1.01)  LDD0559  [21]
 LDCM0243  AC125 HCT 116 C36(0.86); C65(1.11)  LDD0560  [21]
 LDCM0244  AC126 HCT 116 C36(1.02); C65(1.40)  LDD0561  [21]
 LDCM0245  AC127 HCT 116 C36(0.99); C65(1.62)  LDD0562  [21]
 LDCM0246  AC128 HCT 116 C36(0.94); C65(1.28)  LDD0563  [21]
 LDCM0247  AC129 HCT 116 C36(0.47); C65(1.02)  LDD0564  [21]
 LDCM0249  AC130 HCT 116 C36(0.77); C65(1.28)  LDD0566  [21]
 LDCM0250  AC131 HCT 116 C36(0.47); C65(0.90)  LDD0567  [21]
 LDCM0251  AC132 HCT 116 C36(0.55); C65(1.03)  LDD0568  [21]
 LDCM0252  AC133 HCT 116 C36(0.65); C65(1.04)  LDD0569  [21]
 LDCM0253  AC134 HCT 116 C36(0.67); C65(1.23)  LDD0570  [21]
 LDCM0254  AC135 HCT 116 C36(0.64); C65(1.18)  LDD0571  [21]
 LDCM0255  AC136 HCT 116 C36(1.13); C65(1.21)  LDD0572  [21]
 LDCM0256  AC137 HCT 116 C36(0.90); C65(1.23)  LDD0573  [21]
 LDCM0257  AC138 HCT 116 C36(0.76); C65(1.55)  LDD0574  [21]
 LDCM0258  AC139 HCT 116 C36(0.52); C65(1.23)  LDD0575  [21]
 LDCM0259  AC14 HCT 116 C229(0.94); C65(1.11)  LDD0576  [21]
 LDCM0260  AC140 HCT 116 C36(0.55); C65(1.42)  LDD0577  [21]
 LDCM0261  AC141 HCT 116 C36(0.60); C65(1.33)  LDD0578  [21]
 LDCM0262  AC142 HCT 116 C36(0.51); C65(1.06)  LDD0579  [21]
 LDCM0263  AC143 HCT 116 C229(1.03); C36(1.17); C65(1.36)  LDD0580  [21]
 LDCM0264  AC144 HCT 116 C229(0.97); C36(1.60); C65(1.83)  LDD0581  [21]
 LDCM0265  AC145 HCT 116 C229(1.10); C36(1.30); C65(1.30)  LDD0582  [21]
 LDCM0266  AC146 HCT 116 C229(1.33); C65(1.37); C36(1.54)  LDD0583  [21]
 LDCM0267  AC147 HCT 116 C229(0.97); C65(1.57); C36(1.65)  LDD0584  [21]
 LDCM0268  AC148 HCT 116 C229(1.29); C65(2.01); C36(2.43)  LDD0585  [21]
 LDCM0269  AC149 HCT 116 C229(1.31); C65(1.78); C36(1.99)  LDD0586  [21]
 LDCM0270  AC15 HCT 116 C229(1.04); C65(1.19)  LDD0587  [21]
 LDCM0271  AC150 HCT 116 C229(1.04); C65(1.11); C36(1.46)  LDD0588  [21]
 LDCM0272  AC151 HCT 116 C229(1.10); C65(1.15); C36(1.17)  LDD0589  [21]
 LDCM0273  AC152 HCT 116 C229(1.09); C65(1.56); C36(2.79)  LDD0590  [21]
 LDCM0274  AC153 HCT 116 C229(1.29); C65(2.39); C36(2.52)  LDD0591  [21]
 LDCM0621  AC154 HCT 116 C229(1.17); C36(1.54); C65(1.34)  LDD2158  [21]
 LDCM0622  AC155 HCT 116 C229(1.22); C36(1.60); C65(1.35)  LDD2159  [21]
 LDCM0623  AC156 HCT 116 C229(1.07); C36(1.26); C65(1.12)  LDD2160  [21]
 LDCM0624  AC157 HCT 116 C229(1.15); C36(0.83); C65(0.97)  LDD2161  [21]
 LDCM0276  AC17 HCT 116 C36(0.67); C65(1.10); C229(1.13)  LDD0593  [21]
 LDCM0277  AC18 HCT 116 C36(0.49); C229(1.08); C65(1.67)  LDD0594  [21]
 LDCM0278  AC19 HCT 116 C36(0.50); C229(1.08); C65(1.09)  LDD0595  [21]
 LDCM0279  AC2 HCT 116 C65(1.10); C36(1.29); C229(1.40)  LDD0596  [21]
 LDCM0280  AC20 HCT 116 C36(0.83); C65(1.16); C229(1.22)  LDD0597  [21]
 LDCM0281  AC21 HCT 116 C36(0.71); C229(0.97); C65(1.24)  LDD0598  [21]
 LDCM0282  AC22 HCT 116 C36(0.72); C229(1.15); C65(1.19)  LDD0599  [21]
 LDCM0283  AC23 HCT 116 C36(0.88); C229(1.04); C65(1.51)  LDD0600  [21]
 LDCM0284  AC24 HCT 116 C36(0.53); C65(0.96); C229(1.10)  LDD0601  [21]
 LDCM0285  AC25 HCT 116 C65(1.17)  LDD0602  [21]
 LDCM0286  AC26 HCT 116 C65(1.47)  LDD0603  [21]
 LDCM0287  AC27 HCT 116 C65(1.18)  LDD0604  [21]
 LDCM0288  AC28 HCT 116 C65(1.34)  LDD0605  [21]
 LDCM0289  AC29 HCT 116 C65(1.37)  LDD0606  [21]
 LDCM0290  AC3 HCT 116 C65(1.00); C36(1.21); C229(1.33)  LDD0607  [21]
 LDCM0291  AC30 HCT 116 C65(1.43)  LDD0608  [21]
 LDCM0292  AC31 HCT 116 C65(1.35)  LDD0609  [21]
 LDCM0293  AC32 HCT 116 C65(1.56)  LDD0610  [21]
 LDCM0294  AC33 HCT 116 C65(1.39)  LDD0611  [21]
 LDCM0295  AC34 HCT 116 C65(1.75)  LDD0612  [21]
 LDCM0296  AC35 HCT 116 C65(0.99); C36(1.14)  LDD0613  [21]
 LDCM0297  AC36 HCT 116 C36(0.91); C65(1.19)  LDD0614  [21]
 LDCM0298  AC37 HCT 116 C36(0.87); C65(1.02)  LDD0615  [21]
 LDCM0299  AC38 HCT 116 C65(0.95); C36(1.57)  LDD0616  [21]
 LDCM0300  AC39 HCT 116 C65(1.07); C36(1.35)  LDD0617  [21]
 LDCM0301  AC4 HCT 116 C65(1.34); C36(1.50); C229(1.64)  LDD0618  [21]
 LDCM0302  AC40 HCT 116 C65(1.28); C36(1.67)  LDD0619  [21]
 LDCM0303  AC41 HCT 116 C36(0.82); C65(1.22)  LDD0620  [21]
 LDCM0304  AC42 HCT 116 C36(1.08); C65(1.18)  LDD0621  [21]
 LDCM0305  AC43 HCT 116 C36(0.45); C65(1.38)  LDD0622  [21]
 LDCM0306  AC44 HCT 116 C36(0.83); C65(1.11)  LDD0623  [21]
 LDCM0307  AC45 HCT 116 C36(0.78); C65(1.35)  LDD0624  [21]
 LDCM0308  AC46 HCT 116 C36(0.49); C65(1.19); C229(1.62)  LDD0625  [21]
 LDCM0309  AC47 HCT 116 C36(0.73); C65(1.20); C229(1.34)  LDD0626  [21]
 LDCM0310  AC48 HCT 116 C36(0.52); C65(1.23); C229(1.38)  LDD0627  [21]
 LDCM0311  AC49 HCT 116 C65(1.68); C229(1.80); C36(1.91)  LDD0628  [21]
 LDCM0312  AC5 HCT 116 C65(1.33); C229(1.78); C36(2.92)  LDD0629  [21]
 LDCM0313  AC50 HCT 116 C36(1.06); C65(1.76); C229(1.84)  LDD0630  [21]
 LDCM0314  AC51 HCT 116 C36(0.40); C65(0.99); C229(1.44)  LDD0631  [21]
 LDCM0315  AC52 HCT 116 C36(0.81); C65(1.29); C229(1.39)  LDD0632  [21]
 LDCM0316  AC53 HCT 116 C36(1.09); C229(1.43); C65(1.46)  LDD0633  [21]
 LDCM0317  AC54 HCT 116 C65(1.37); C229(1.48); C36(1.62)  LDD0634  [21]
 LDCM0318  AC55 HCT 116 C36(0.90); C229(1.45); C65(1.58)  LDD0635  [21]
 LDCM0319  AC56 HCT 116 C229(1.29); C36(1.99); C65(2.18)  LDD0636  [21]
 LDCM0320  AC57 HCT 116 C36(0.89); C65(1.47); C229(1.74)  LDD0637  [21]
 LDCM0321  AC58 HCT 116 C36(1.10); C65(1.51); C229(2.68)  LDD0638  [21]
 LDCM0322  AC59 HCT 116 C36(1.04); C65(1.56); C229(2.04)  LDD0639  [21]
 LDCM0323  AC6 HCT 116 C229(1.04); C65(1.25)  LDD0640  [21]
 LDCM0324  AC60 HCT 116 C36(1.21); C65(1.49); C229(2.11)  LDD0641  [21]
 LDCM0325  AC61 HCT 116 C36(0.99); C65(1.47); C229(1.77)  LDD0642  [21]
 LDCM0326  AC62 HCT 116 C36(0.81); C65(1.84); C229(2.44)  LDD0643  [21]
 LDCM0327  AC63 HCT 116 C36(0.91); C65(1.79); C229(2.02)  LDD0644  [21]
 LDCM0328  AC64 HCT 116 C36(0.88); C65(1.65); C229(2.24)  LDD0645  [21]
 LDCM0329  AC65 HCT 116 C36(1.05); C65(1.70); C229(2.76)  LDD0646  [21]
 LDCM0330  AC66 HCT 116 C36(0.98); C65(1.70); C229(2.42)  LDD0647  [21]
 LDCM0331  AC67 HCT 116 C36(0.98); C65(2.32); C229(3.16)  LDD0648  [21]
 LDCM0332  AC68 HCT 116 C36(0.86); C65(1.14)  LDD0649  [21]
 LDCM0333  AC69 HCT 116 C36(0.96); C65(1.38)  LDD0650  [21]
 LDCM0334  AC7 HCT 116 C229(1.02); C65(1.19)  LDD0651  [21]
 LDCM0335  AC70 HCT 116 C36(0.80); C65(1.63)  LDD0652  [21]
 LDCM0336  AC71 HCT 116 C36(0.77); C65(1.08)  LDD0653  [21]
 LDCM0337  AC72 HCT 116 C36(0.84); C65(1.30)  LDD0654  [21]
 LDCM0338  AC73 HCT 116 C36(0.98); C65(1.92)  LDD0655  [21]
 LDCM0339  AC74 HCT 116 C36(1.20); C65(1.95)  LDD0656  [21]
 LDCM0340  AC75 HCT 116 C36(0.81); C65(2.11)  LDD0657  [21]
 LDCM0341  AC76 HCT 116 C36(0.89); C65(1.43)  LDD0658  [21]
 LDCM0342  AC77 HCT 116 C36(0.99); C65(1.52)  LDD0659  [21]
 LDCM0343  AC78 HCT 116 C36(1.27); C65(1.45)  LDD0660  [21]
 LDCM0344  AC79 HCT 116 C36(0.80); C65(1.22)  LDD0661  [21]
 LDCM0345  AC8 HCT 116 C229(1.04); C65(1.40)  LDD0662  [21]
 LDCM0346  AC80 HCT 116 C36(1.09); C65(1.36)  LDD0663  [21]
 LDCM0347  AC81 HCT 116 C36(0.66); C65(1.22)  LDD0664  [21]
 LDCM0348  AC82 HCT 116 C36(0.80); C65(2.57)  LDD0665  [21]
 LDCM0349  AC83 HCT 116 C65(1.81); C36(1.90)  LDD0666  [21]
 LDCM0350  AC84 HCT 116 C65(1.75); C36(2.50)  LDD0667  [21]
 LDCM0351  AC85 HCT 116 C65(1.49); C36(1.84)  LDD0668  [21]
 LDCM0352  AC86 HCT 116 C65(1.15); C36(1.18)  LDD0669  [21]
 LDCM0353  AC87 HCT 116 C36(1.04); C65(1.10)  LDD0670  [21]
 LDCM0354  AC88 HCT 116 C65(1.22); C36(1.35)  LDD0671  [21]
 LDCM0355  AC89 HCT 116 C36(1.08); C65(1.33)  LDD0672  [21]
 LDCM0357  AC90 HCT 116 C36(0.54); C65(0.98)  LDD0674  [21]
 LDCM0358  AC91 HCT 116 C65(1.70); C36(1.73)  LDD0675  [21]
 LDCM0359  AC92 HCT 116 C36(1.31); C65(1.66)  LDD0676  [21]
 LDCM0360  AC93 HCT 116 C65(1.41); C36(1.59)  LDD0677  [21]
 LDCM0361  AC94 HCT 116 C65(1.20); C36(1.86)  LDD0678  [21]
 LDCM0362  AC95 HCT 116 C36(0.88); C65(1.19)  LDD0679  [21]
 LDCM0363  AC96 HCT 116 C36(1.16); C65(1.39)  LDD0680  [21]
 LDCM0364  AC97 HCT 116 C65(1.75); C36(2.24)  LDD0681  [21]
 LDCM0365  AC98 HCT 116 C65(1.77); C36(1.88)  LDD0682  [21]
 LDCM0366  AC99 HCT 116 C36(1.02); C65(1.09)  LDD0683  [21]
 LDCM0545  Acetamide MDA-MB-231 C229(0.48)  LDD2138  [12]
 LDCM0520  AKOS000195272 MDA-MB-231 C36(0.87); C229(0.95)  LDD2113  [12]
 LDCM0248  AKOS034007472 HCT 116 C229(0.88); C65(0.93)  LDD0565  [21]
 LDCM0356  AKOS034007680 HCT 116 C229(1.10); C65(1.18)  LDD0673  [21]
 LDCM0275  AKOS034007705 HCT 116 C229(1.39); C65(1.77)  LDD0592  [21]
 LDCM0156  Aniline NCI-H1299 12.33  LDD0403  [1]
 LDCM0498  BS-3668 MDA-MB-231 C36(0.65)  LDD2091  [12]
 LDCM0089  C30 HEK-293T 1.35  LDD0210  [10]
 LDCM0088  C45 HEK-293T 5.23  LDD0201  [10]
 LDCM0087  Capsaicin HEK-293T 6.58  LDD0185  [16]
 LDCM0630  CCW28-3 231MFP C36(1.63); C65(1.04)  LDD2214  [46]
 LDCM0108  Chloroacetamide HeLa C36(0.00); H183(0.00); H46(0.00); C229(0.00)  LDD0222  [35]
 LDCM0632  CL-Sc Hep-G2 C2(20.00); C65(1.01); C36(0.79); C65(0.75)  LDD2227  [28]
 LDCM0367  CL1 HCT 116 C65(0.97)  LDD0684  [21]
 LDCM0368  CL10 HCT 116 C65(1.41)  LDD0685  [21]
 LDCM0369  CL100 HCT 116 C65(1.28); C229(1.34); C36(1.54)  LDD0686  [21]
 LDCM0370  CL101 HCT 116 C229(0.99); C65(1.08)  LDD0687  [21]
 LDCM0371  CL102 HCT 116 C65(1.12); C229(1.26)  LDD0688  [21]
 LDCM0372  CL103 HCT 116 C229(0.97); C65(0.99)  LDD0689  [21]
 LDCM0373  CL104 HCT 116 C229(0.96); C65(1.10)  LDD0690  [21]
 LDCM0374  CL105 HCT 116 C36(0.70); C229(1.30); C65(1.38)  LDD0691  [21]
 LDCM0375  CL106 HCT 116 C36(0.79); C229(1.27); C65(1.89)  LDD0692  [21]
 LDCM0376  CL107 HCT 116 C36(0.76); C229(1.46); C65(1.72)  LDD0693  [21]
 LDCM0377  CL108 HCT 116 C36(0.69); C229(1.27); C65(1.56)  LDD0694  [21]
 LDCM0378  CL109 HCT 116 C36(0.64); C229(1.27); C65(1.35)  LDD0695  [21]
 LDCM0379  CL11 HCT 116 C65(1.61)  LDD0696  [21]
 LDCM0380  CL110 HCT 116 C36(0.80); C229(1.31); C65(1.49)  LDD0697  [21]
 LDCM0381  CL111 HCT 116 C36(1.01); C229(1.13); C65(1.52)  LDD0698  [21]
 LDCM0382  CL112 HCT 116 C65(1.30)  LDD0699  [21]
 LDCM0383  CL113 HCT 116 C65(1.65)  LDD0700  [21]
 LDCM0384  CL114 HCT 116 C65(1.61)  LDD0701  [21]
 LDCM0385  CL115 HCT 116 C65(1.24)  LDD0702  [21]
 LDCM0386  CL116 HCT 116 C65(1.26)  LDD0703  [21]
 LDCM0387  CL117 HCT 116 C65(1.54); C36(1.81)  LDD0704  [21]
 LDCM0388  CL118 HCT 116 C36(0.78); C65(1.08)  LDD0705  [21]
 LDCM0389  CL119 HCT 116 C36(0.60); C65(1.21)  LDD0706  [21]
 LDCM0390  CL12 HCT 116 C65(1.40)  LDD0707  [21]
 LDCM0391  CL120 HCT 116 C36(0.44); C65(1.15)  LDD0708  [21]
 LDCM0392  CL121 HCT 116 C36(0.72); C65(1.18); C229(1.28)  LDD0709  [21]
 LDCM0393  CL122 HCT 116 C65(1.33); C36(1.35); C229(1.52)  LDD0710  [21]
 LDCM0394  CL123 HCT 116 C36(0.96); C229(1.09); C65(1.44)  LDD0711  [21]
 LDCM0395  CL124 HCT 116 C36(1.14); C229(1.49); C65(1.58)  LDD0712  [21]
 LDCM0396  CL125 HCT 116 C36(0.87); C65(1.17); C229(1.38)  LDD0713  [21]
 LDCM0397  CL126 HCT 116 C36(0.93); C229(1.18); C65(1.46)  LDD0714  [21]
 LDCM0398  CL127 HCT 116 C36(1.09); C65(1.28); C229(1.29)  LDD0715  [21]
 LDCM0399  CL128 HCT 116 C36(0.83); C65(1.34); C229(2.11)  LDD0716  [21]
 LDCM0400  CL13 HCT 116 C65(1.14)  LDD0717  [21]
 LDCM0401  CL14 HCT 116 C65(1.01)  LDD0718  [21]
 LDCM0402  CL15 HCT 116 C65(1.15)  LDD0719  [21]
 LDCM0403  CL16 HCT 116 C229(0.80); C65(1.15)  LDD0720  [21]
 LDCM0404  CL17 HCT 116 C36(0.88); C65(1.06); C229(1.06)  LDD0721  [21]
 LDCM0405  CL18 HCT 116 C36(0.82); C229(0.99); C65(1.26)  LDD0722  [21]
 LDCM0406  CL19 HCT 116 C229(0.97); C65(0.98); C36(1.19)  LDD0723  [21]
 LDCM0407  CL2 HCT 116 C65(0.92)  LDD0724  [21]
 LDCM0408  CL20 HCT 116 C229(1.01); C36(1.08); C65(1.10)  LDD0725  [21]
 LDCM0409  CL21 HCT 116 C36(0.99); C229(1.13); C65(1.45)  LDD0726  [21]
 LDCM0410  CL22 HCT 116 C229(1.01); C36(1.49); C65(1.56)  LDD0727  [21]
 LDCM0411  CL23 HCT 116 C229(0.85); C65(1.12); C36(1.36)  LDD0728  [21]
 LDCM0412  CL24 HCT 116 C229(0.94); C36(0.86); C65(1.27)  LDD0729  [21]
 LDCM0413  CL25 HCT 116 C229(0.84); C36(0.86); C65(1.31)  LDD0730  [21]
 LDCM0414  CL26 HCT 116 C229(0.82); C36(1.03); C65(1.29)  LDD0731  [21]
 LDCM0415  CL27 HCT 116 C229(1.03); C36(1.15); C65(0.85)  LDD0732  [21]
 LDCM0416  CL28 HCT 116 C229(0.99); C36(0.91); C65(1.10)  LDD0733  [21]
 LDCM0417  CL29 HCT 116 C229(0.87); C36(1.09); C65(1.10)  LDD0734  [21]
 LDCM0418  CL3 HCT 116 C65(0.96)  LDD0735  [21]
 LDCM0419  CL30 HCT 116 C229(0.70); C36(1.14); C65(0.97)  LDD0736  [21]
 LDCM0420  CL31 HCT 116 C229(0.80); C36(1.04); C65(1.14)  LDD0737  [21]
 LDCM0421  CL32 HCT 116 C36(1.03); C65(1.43)  LDD0738  [21]
 LDCM0422  CL33 HCT 116 C36(1.05); C65(1.47)  LDD0739  [21]
 LDCM0423  CL34 HCT 116 C36(1.30); C65(1.49)  LDD0740  [21]
 LDCM0424  CL35 HCT 116 C36(1.66); C65(1.50)  LDD0741  [21]
 LDCM0425  CL36 HCT 116 C36(1.17); C65(1.42)  LDD0742  [21]
 LDCM0426  CL37 HCT 116 C36(1.58); C65(1.42)  LDD0743  [21]
 LDCM0428  CL39 HCT 116 C36(1.35); C65(1.57)  LDD0745  [21]
 LDCM0429  CL4 HCT 116 C65(0.90)  LDD0746  [21]
 LDCM0430  CL40 HCT 116 C36(1.22); C65(1.60)  LDD0747  [21]
 LDCM0431  CL41 HCT 116 C36(1.32); C65(1.31)  LDD0748  [21]
 LDCM0432  CL42 HCT 116 C36(2.20); C65(2.34)  LDD0749  [21]
 LDCM0433  CL43 HCT 116 C36(1.28); C65(1.59)  LDD0750  [21]
 LDCM0434  CL44 HCT 116 C36(1.21); C65(1.35)  LDD0751  [21]
 LDCM0435  CL45 HCT 116 C36(1.39); C65(1.74)  LDD0752  [21]
 LDCM0436  CL46 HCT 116 C229(1.14); C36(0.51); C65(0.90)  LDD0753  [21]
 LDCM0437  CL47 HCT 116 C229(0.77); C36(0.57); C65(0.97)  LDD0754  [21]
 LDCM0438  CL48 HCT 116 C229(0.97); C36(0.62); C65(0.88)  LDD0755  [21]
 LDCM0439  CL49 HCT 116 C229(1.06); C36(0.72); C65(0.99)  LDD0756  [21]
 LDCM0440  CL5 HCT 116 C65(0.95)  LDD0757  [21]
 LDCM0441  CL50 HCT 116 C229(1.00); C36(0.70); C65(0.98)  LDD0758  [21]
 LDCM0442  CL51 HCT 116 C229(1.19); C36(0.56); C65(0.91)  LDD0759  [21]
 LDCM0443  CL52 HCT 116 C229(0.95); C36(0.53); C65(0.95)  LDD0760  [21]
 LDCM0444  CL53 HCT 116 C229(0.97); C36(0.52); C65(0.94)  LDD0761  [21]
 LDCM0445  CL54 HCT 116 C229(1.04); C36(0.45); C65(0.88)  LDD0762  [21]
 LDCM0446  CL55 HCT 116 C229(0.81); C36(0.46); C65(0.92)  LDD0763  [21]
 LDCM0447  CL56 HCT 116 C229(0.99); C36(0.90); C65(1.06)  LDD0764  [21]
 LDCM0448  CL57 HCT 116 C229(1.13); C36(0.54); C65(0.88)  LDD0765  [21]
 LDCM0449  CL58 HCT 116 C229(0.88); C36(0.64); C65(0.84)  LDD0766  [21]
 LDCM0450  CL59 HCT 116 C229(0.67); C36(0.80); C65(0.87)  LDD0767  [21]
 LDCM0451  CL6 HCT 116 C65(1.15)  LDD0768  [21]
 LDCM0452  CL60 HCT 116 C229(1.10); C36(0.88); C65(1.03)  LDD0769  [21]
 LDCM0453  CL61 HCT 116 C229(1.42); C36(0.93); C65(1.10)  LDD0770  [21]
 LDCM0454  CL62 HCT 116 C229(1.15); C36(0.80); C65(1.21)  LDD0771  [21]
 LDCM0455  CL63 HCT 116 C229(1.20); C36(1.56); C65(1.39)  LDD0772  [21]
 LDCM0456  CL64 HCT 116 C229(1.31); C36(1.43); C65(1.22)  LDD0773  [21]
 LDCM0457  CL65 HCT 116 C229(1.00); C36(1.23); C65(1.14)  LDD0774  [21]
 LDCM0458  CL66 HCT 116 C229(1.31); C36(2.11); C65(1.60)  LDD0775  [21]
 LDCM0459  CL67 HCT 116 C229(0.97); C36(1.74); C65(1.34)  LDD0776  [21]
 LDCM0460  CL68 HCT 116 C229(1.12); C36(2.29); C65(1.28)  LDD0777  [21]
 LDCM0461  CL69 HCT 116 C229(1.30); C36(1.15); C65(1.40)  LDD0778  [21]
 LDCM0462  CL7 HCT 116 C65(1.30)  LDD0779  [21]
 LDCM0463  CL70 HCT 116 C229(0.81); C36(1.20); C65(1.30)  LDD0780  [21]
 LDCM0464  CL71 HCT 116 C229(1.22); C36(1.52); C65(1.59)  LDD0781  [21]
 LDCM0465  CL72 HCT 116 C229(0.98); C36(1.45); C65(1.17)  LDD0782  [21]
 LDCM0466  CL73 HCT 116 C229(1.31); C36(1.29); C65(1.42)  LDD0783  [21]
 LDCM0467  CL74 HCT 116 C229(1.13); C36(1.26); C65(1.52)  LDD0784  [21]
 LDCM0469  CL76 HCT 116 C229(0.81); C36(1.74); C65(1.24)  LDD0786  [21]
 LDCM0470  CL77 HCT 116 C229(0.94); C36(2.24); C65(1.35)  LDD0787  [21]
 LDCM0471  CL78 HCT 116 C229(0.97); C36(1.14); C65(1.26)  LDD0788  [21]
 LDCM0472  CL79 HCT 116 C229(1.00); C36(1.54); C65(1.32)  LDD0789  [21]
 LDCM0473  CL8 HCT 116 C65(2.18)  LDD0790  [21]
 LDCM0474  CL80 HCT 116 C229(0.94); C36(1.36); C65(1.19)  LDD0791  [21]
 LDCM0475  CL81 HCT 116 C229(1.02); C36(0.97); C65(1.21)  LDD0792  [21]
 LDCM0476  CL82 HCT 116 C229(0.70); C36(1.40); C65(1.75)  LDD0793  [21]
 LDCM0477  CL83 HCT 116 C229(0.91); C36(1.30); C65(1.65)  LDD0794  [21]
 LDCM0478  CL84 HCT 116 C229(0.94); C36(1.48); C65(2.29)  LDD0795  [21]
 LDCM0479  CL85 HCT 116 C229(0.63); C36(2.76); C65(1.37)  LDD0796  [21]
 LDCM0480  CL86 HCT 116 C229(0.66); C36(1.88); C65(1.25)  LDD0797  [21]
 LDCM0481  CL87 HCT 116 C229(0.91); C36(2.65); C65(1.22)  LDD0798  [21]
 LDCM0482  CL88 HCT 116 C229(0.84); C36(2.27); C65(1.62)  LDD0799  [21]
 LDCM0483  CL89 HCT 116 C229(0.87); C36(1.95); C65(2.51)  LDD0800  [21]
 LDCM0484  CL9 HCT 116 C65(1.16)  LDD0801  [21]
 LDCM0485  CL90 HCT 116 C229(0.69); C36(1.73); C65(1.04)  LDD0802  [21]
 LDCM0486  CL91 HCT 116 C229(1.51); C36(1.31); C65(1.13)  LDD0803  [21]
 LDCM0487  CL92 HCT 116 C229(1.20); C36(1.71); C65(1.24)  LDD0804  [21]
 LDCM0488  CL93 HCT 116 C229(1.19); C36(1.45); C65(1.18)  LDD0805  [21]
 LDCM0489  CL94 HCT 116 C229(1.66); C36(1.73); C65(1.31)  LDD0806  [21]
 LDCM0490  CL95 HCT 116 C229(1.77); C36(2.02); C65(1.54)  LDD0807  [21]
 LDCM0491  CL96 HCT 116 C229(1.33); C36(1.68); C65(1.13)  LDD0808  [21]
 LDCM0492  CL97 HCT 116 C229(1.41); C36(2.06); C65(1.28)  LDD0809  [21]
 LDCM0493  CL98 HCT 116 C229(1.53); C36(2.69); C65(1.31)  LDD0810  [21]
 LDCM0494  CL99 HCT 116 C229(1.42); C36(2.45); C65(1.12)  LDD0811  [21]
 LDCM0189  Compound 16 HEK-293T 10.70  LDD0492  [41]
 LDCM0185  Compound 17 HEK-293T 13.16  LDD0504  [41]
 LDCM0182  Compound 18 HEK-293T 3.78  LDD0501  [41]
 LDCM0184  Compound 20 HEK-293T 13.92  LDD0503  [41]
 LDCM0191  Compound 21 HEK-293T 6.19  LDD0493  [41]
 LDCM0186  Compound 31 HEK-293T 10.95  LDD0506  [41]
 LDCM0187  Compound 32 HEK-293T 16.98  LDD0507  [41]
 LDCM0188  Compound 33 HEK-293T 9.82  LDD0505  [41]
 LDCM0190  Compound 34 HEK-293T 10.80  LDD0497  [41]
 LDCM0192  Compound 35 HEK-293T 8.92  LDD0491  [41]
 LDCM0193  Compound 36 HEK-293T 6.84  LDD0494  [41]
 LDCM0194  Compound 37 HEK-293T 9.93  LDD0498  [41]
 LDCM0195  Compound 38 HEK-293T 12.82  LDD0499  [41]
 LDCM0196  Compound 39 HEK-293T 6.45  LDD0496  [41]
 LDCM0197  Compound 40 HEK-293T 8.67  LDD0495  [41]
 LDCM0181  Compound 41 HEK-293T 4.27  LDD0502  [41]
 LDCM0033  Curcusone1d MCF-7 3.03  LDD0188  [14]
 LDCM0634  CY-0357 Hep-G2 C229(1.72); C65(1.03)  LDD2228  [28]
 LDCM0198  Dimethyl Fumarate(DMF) T cell C65(4.39)  LDD0513  [47]
 LDCM0028  Dobutamine HEK-293T 4.00  LDD0180  [16]
 LDCM0495  E2913 HEK-293T C36(0.89); C65(0.91); C229(0.84)  LDD1698  [48]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C65(16.10); C36(2.18); C229(0.66)  LDD1702  [12]
 LDCM0175  Ethacrynic acid HeLa N.A.  LDD0440  [20]
 LDCM0625  F8 Ramos C65(1.01); C36(1.36)  LDD2187  [49]
 LDCM0572  Fragment10 MDA-MB-231 C65(3.29)  LDD1465  [50]
 LDCM0573  Fragment11 MDA-MB-231 C65(1.35)  LDD1467  [50]
 LDCM0574  Fragment12 MDA-MB-231 C65(3.91)  LDD1468  [50]
 LDCM0575  Fragment13 MDA-MB-231 C65(0.95)  LDD1469  [50]
 LDCM0576  Fragment14 MDA-MB-231 C65(1.74)  LDD1471  [50]
 LDCM0579  Fragment20 Ramos C65(6.89)  LDD2194  [49]
 LDCM0580  Fragment21 MDA-MB-231 C65(2.94)  LDD1473  [50]
 LDCM0582  Fragment23 Ramos C65(0.90); C36(0.60)  LDD2196  [49]
 LDCM0578  Fragment27 MDA-MB-231 C65(1.59)  LDD1474  [50]
 LDCM0586  Fragment28 MDA-MB-231 C65(1.19)  LDD1475  [50]
 LDCM0588  Fragment30 Ramos C65(1.54); C36(0.79)  LDD2199  [49]
 LDCM0589  Fragment31 Ramos C65(1.01)  LDD1478  [50]
 LDCM0590  Fragment32 Ramos C65(2.12)  LDD2201  [49]
 LDCM0468  Fragment33 HCT 116 C229(1.20); C36(1.43); C65(1.23)  LDD0785  [21]
 LDCM0596  Fragment38 MDA-MB-231 C65(20.00)  LDD1480  [50]
 LDCM0566  Fragment4 MDA-MB-231 C65(4.74)  LDD1461  [50]
 LDCM0599  Fragment41 MDA-MB-231 C65(1.44)  LDD1481  [50]
 LDCM0427  Fragment51 HCT 116 C36(2.66); C65(3.26)  LDD0744  [21]
 LDCM0610  Fragment52 Ramos C65(1.34); C36(9.32)  LDD2204  [49]
 LDCM0614  Fragment56 MDA-MB-231 C65(0.85)  LDD1484  [50]
 LDCM0569  Fragment7 Ramos C65(3.04)  LDD2186  [49]
 LDCM0570  Fragment8 MDA-MB-231 C65(6.17)  LDD1462  [50]
 LDCM0571  Fragment9 Ramos C65(0.78)  LDD1464  [50]
 LDCM0015  HNE MDA-MB-231 C65(1.06); C229(1.02)  LDD0346  [49]
 LDCM0107  IAA HeLa H46(0.00); H183(0.00); C229(0.00); H273(0.00)  LDD0221  [35]
 LDCM0179  JZ128 PC-3 N.A.  LDD0462  [11]
 LDCM0022  KB02 HCT 116 C65(2.02)  LDD0080  [21]
 LDCM0023  KB03 HCT 116 C65(1.50)  LDD0081  [21]
 LDCM0024  KB05 HCT 116 C65(4.09)  LDD0082  [21]
 LDCM0109  NEM HeLa H46(0.00); H183(0.00); H273(0.00)  LDD0223  [35]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C36(0.71)  LDD2089  [12]
 LDCM0497  Nucleophilic fragment 11b MDA-MB-231 C65(0.70)  LDD2090  [12]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C65(0.95)  LDD2092  [12]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C36(1.06); C229(1.07); C65(1.10)  LDD2093  [12]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C229(0.08); C65(0.84)  LDD2096  [12]
 LDCM0504  Nucleophilic fragment 15a MDA-MB-231 C229(1.04)  LDD2097  [12]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C36(0.99); C229(1.02); C65(1.28)  LDD2099  [12]
 LDCM0507  Nucleophilic fragment 16b MDA-MB-231 C36(1.12)  LDD2100  [12]
 LDCM0508  Nucleophilic fragment 17a MDA-MB-231 C36(0.96); C229(1.06)  LDD2101  [12]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C36(0.85)  LDD2104  [12]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C36(0.67); C65(1.10)  LDD2105  [12]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C36(1.06); C229(1.02); C65(1.04)  LDD2107  [12]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C36(0.95)  LDD2108  [12]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C36(1.44); C229(1.17)  LDD2109  [12]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C36(1.09); C229(1.16); C65(1.07)  LDD2111  [12]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C36(0.76); C65(0.89)  LDD2114  [12]
 LDCM0522  Nucleophilic fragment 24a MDA-MB-231 C36(0.69); C229(0.57)  LDD2115  [12]
 LDCM0523  Nucleophilic fragment 24b MDA-MB-231 C36(0.30); C65(1.36)  LDD2116  [12]
 LDCM0525  Nucleophilic fragment 25b MDA-MB-231 C229(0.62); C65(1.19)  LDD2118  [12]
 LDCM0526  Nucleophilic fragment 26a MDA-MB-231 C36(1.33); C65(1.54)  LDD2119  [12]
 LDCM0529  Nucleophilic fragment 27b MDA-MB-231 C229(0.21); C65(1.44)  LDD2122  [12]
 LDCM0530  Nucleophilic fragment 28a MDA-MB-231 C36(0.94); C229(0.98); C65(0.96)  LDD2123  [12]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C36(0.87); C65(1.18)  LDD2124  [12]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C36(1.01); C229(0.95); C65(0.88)  LDD2125  [12]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C36(1.88); C229(0.15); C65(1.81)  LDD2126  [12]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C36(1.00); C229(0.98)  LDD2127  [12]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C36(0.95); C229(1.12)  LDD2129  [12]
 LDCM0540  Nucleophilic fragment 35 MDA-MB-231 C229(0.68)  LDD2133  [12]
 LDCM0541  Nucleophilic fragment 36 MDA-MB-231 C36(0.80); C229(0.62)  LDD2134  [12]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C36(0.94); C229(1.21); C65(1.36)  LDD2135  [12]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C36(1.42); C229(1.10); C65(1.00)  LDD2136  [12]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C36(0.90); C229(0.99); C65(1.06)  LDD2137  [12]
 LDCM0211  Nucleophilic fragment 3b MDA-MB-231 C229(1.92)  LDD1700  [12]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C36(0.94); C229(1.19); C65(0.95)  LDD2140  [12]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C36(0.82)  LDD2141  [12]
 LDCM0550  Nucleophilic fragment 5a MDA-MB-231 C36(3.52); C229(1.68); C65(1.66)  LDD2144  [12]
 LDCM0551  Nucleophilic fragment 5b MDA-MB-231 C36(4.13)  LDD2145  [12]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C36(1.16); C229(1.14); C65(0.94)  LDD2146  [12]
 LDCM0554  Nucleophilic fragment 7a MDA-MB-231 C36(0.72); C229(0.54)  LDD2148  [12]
 LDCM0555  Nucleophilic fragment 7b MDA-MB-231 C36(1.59); C65(1.26)  LDD2149  [12]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C36(0.58); C229(0.72)  LDD2150  [12]
 LDCM0557  Nucleophilic fragment 8b MDA-MB-231 C36(0.70); C229(0.64); C65(4.94)  LDD2151  [12]
 LDCM0627  NUDT7-COV-1 HEK-293T C36(0.80); C36(0.68); C36(0.62); C65(0.57)  LDD2206  [51]
 LDCM0628  OTUB2-COV-1 HEK-293T C2(15.00); C36(1.23); C36(0.94); C229(0.78)  LDD2207  [51]
 LDCM0014  Panhematin HEK-293T 6.51  LDD0062  [18]
 LDCM0029  Quercetin HEK-293T 6.02  LDD0181  [16]
 LDCM0131  RA190 MM1.R 2.06  LDD0299  [19]
 LDCM0016  Ranjitkar_cp1 MDA-MB-231 8.33  LDD0123  [15]
 LDCM0170  Structure8 Ramos 13.98; 8.41  LDD0433  [52]
 LDCM0003  Sulforaphane MDA-MB-231 2.34  LDD0160  [13]
 LDCM0110  W12 Hep-G2 C65(14.56)  LDD0237  [6]
 LDCM0111  W14 Hep-G2 C65(13.39)  LDD0238  [6]
 LDCM0112  W16 Hep-G2 C65(0.59)  LDD0239  [6]
 LDCM0113  W17 Hep-G2 C65(12.01)  LDD0240  [6]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Transporter and channel
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Voltage-dependent anion-selective channel protein 1 (VDAC1) Eukaryotic mitochondrial porin family P21796

The Drug(s) Related To This Target

Phase 2
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Prlx93936 . D0P0EI
Investigative
Click To Hide/Show 2 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Aluminium Monostearate Small molecular drug DB01375
Prlx 93936 . DB06098

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 Hydrazines as versatile chemical biology probes and drug-discovery tools for cofactor-dependent enzymes. bioRxiv, 2020-06.
3 Fatty Acyl Sulfonyl Fluoride as an Activity-Based Probe for Profiling Fatty Acid-Associated Proteins in Living Cells. Chembiochem. 2022 Feb 16;23(4):e202100628. doi: 10.1002/cbic.202100628. Epub 2021 Dec 30.
4 Tranylcypromine specificity for monoamine oxidase is limited by promiscuous protein labelling and lysosomal trapping. RSC Chem Biol. 2020 Aug 12;1(4):209-213. doi: 10.1039/d0cb00048e. eCollection 2020 Oct 1.
Mass spectrometry data entry: PXD018580
5 Charting the Chemical Space of Acrylamide-Based Inhibitors of zDHHC20. ACS Med Chem Lett. 2022 Sep 26;13(10):1648-1654. doi: 10.1021/acsmedchemlett.2c00336. eCollection 2022 Oct 13.
6 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.
7 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.
8 Ynamide Electrophile for the Profiling of Ligandable Carboxyl Residues in Live Cells and the Development of New Covalent Inhibitors. J Med Chem. 2022 Aug 11;65(15):10408-10418. doi: 10.1021/acs.jmedchem.2c00272. Epub 2022 Jul 26.
9 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
10 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.
11 A Chemoproteomic Strategy for Direct and Proteome-Wide Covalent Inhibitor Target-Site Identification. J Am Chem Soc. 2019 Jan 9;141(1):191-203. doi: 10.1021/jacs.8b07911. Epub 2018 Dec 20.
12 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
13 Competition-based, quantitative chemical proteomics in breast cancer cells identifies new target profiles for sulforaphane. Chem Commun (Camb). 2017 May 4;53(37):5182-5185. doi: 10.1039/c6cc08797c.
Mass spectrometry data entry: PXD006279
14 Total Synthesis and Target Identification of the Curcusone Diterpenes. J Am Chem Soc. 2021 Mar 24;143(11):4379-4386. doi: 10.1021/jacs.1c00557. Epub 2021 Mar 11.
15 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.
16 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
17 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
18 A Chemical Proteomic Map of Heme-Protein Interactions. J Am Chem Soc. 2022 Aug 24;144(33):15013-15019. doi: 10.1021/jacs.2c06104. Epub 2022 Aug 12.
Mass spectrometry data entry: PXD034651
19 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.
20 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.
21 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.
22 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
23 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.
24 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
25 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
26 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
27 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
28 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
29 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
30 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
31 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
32 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
33 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
34 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.
35 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.
36 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.
37 Differently Tagged Probes for Protein Profiling of Mitochondria. Chembiochem. 2019 May 2;20(9):1155-1160. doi: 10.1002/cbic.201800735. Epub 2019 Mar 26.
38 Quantitative Proteomics Reveals Cellular Off-Targets of a DDR1 Inhibitor. ACS Med Chem Lett. 2020 Feb 5;11(4):535-540. doi: 10.1021/acsmedchemlett.9b00658. eCollection 2020 Apr 9.
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Mass spectrometry data entry: PXD024915 , PXD024913
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