Details of the Target

General Information of Target

Target ID LDTP05128
Target Name Glutathione S-transferase omega-1 (GSTO1)
Gene Name GSTO1
Gene ID 9446
Synonyms
GSTTLP28; Glutathione S-transferase omega-1; GSTO-1; EC 2.5.1.18; Glutathione S-transferase omega 1-1; GSTO 1-1; Glutathione-dependent dehydroascorbate reductase; EC 1.8.5.1; Monomethylarsonic acid reductase; MMA(V) reductase; EC 1.20.4.2; S-(Phenacyl)glutathione reductase; SPG-R
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MSGESARSLGKGSAPPGPVPEGSIRIYSMRFCPFAERTRLVLKAKGIRHEVININLKNKP
EWFFKKNPFGLVPVLENSQGQLIYESAITCEYLDEAYPGKKLLPDDPYEKACQKMILELF
SKVPSLVGSFIRSQNKEDYAGLKEEFRKEFTKLEEVLTNKKTTFFGGNSISMIDYLIWPW
FERLEAMKLNECVDHTPKLKLWMAAMKEDPTVSALLTSEKDWQGFLELYLQNSPEACDYG
L
Target Type
Preclinical
Target Bioclass
Enzyme
Family
GST superfamily, Omega family
Subcellular location
Cytoplasm, cytosol
Function
Exhibits glutathione-dependent thiol transferase and dehydroascorbate reductase activities. Has S-(phenacyl)glutathione reductase activity. Has also glutathione S-transferase activity. Participates in the biotransformation of inorganic arsenic and reduces monomethylarsonic acid (MMA) and dimethylarsonic acid.
TTD ID
T01521
Uniprot ID
P78417
DrugMap ID
TTWO3SH
Ensemble ID
ENST00000369710.8
HGNC ID
HGNC:13312
ChEMBL ID
CHEMBL3174

Target Site Mutations in Different Cell Lines

Cell line Mutation details Probe for labeling this protein in this cell
COLO320 SNV: p.S23W DBIA    Probe Info 

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 56 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		15.00  LDD0402  [1]
A-EBA
 Probe Info  		6.33  LDD0215  [2]
CHEMBL5175495
 Probe Info  		6.82  LDD0196  [3]
CY-1
 Probe Info  		100.00  LDD0243  [4]
CY4
 Probe Info  		100.00  LDD0244  [4]
N1
 Probe Info  		100.00  LDD0242  [4]
FBP2
 Probe Info  		2.99  LDD0317  [5]
TH211
 Probe Info  		Y139(9.91)  LDD0257  [6]
YN-1
 Probe Info  		100.00  LDD0444  [7]
YN-4
 Probe Info  		100.00  LDD0445  [7]
ONAyne
 Probe Info  		K143(0.59); K160(0.35)  LDD0274  [8]
BTD
 Probe Info  		C192(3.58); C32(3.79)  LDD1699  [9]
P11
 Probe Info  		1.31  LDD0210  [10]
P13
 Probe Info  		6.51  LDD0203  [10]
P26
 Probe Info  		1.59  LDD0409  [11]
EN219-alkyne
 Probe Info  		3.52  LDD0298  [12]
Jackson_1
 Probe Info  		3.01  LDD0120  [13]
Johansson_61
 Probe Info  		_(20.00)  LDD1485  [14]
YY4-yne
 Probe Info  		5.17  LDD0400  [15]
AHL-Pu-1
 Probe Info  		C192(4.39)  LDD0169  [16]
DBIA
 Probe Info  		C32(95.41)  LDD0209  [17]
HHS-482
 Probe Info  		Y139(0.97)  LDD0285  [18]
HHS-475
 Probe Info  		Y139(1.20)  LDD0264  [19]
BDBM50514113
 Probe Info  		4.24  LDD0041  [20]
HHS-465
 Probe Info  		Y139(10.00)  LDD2237  [21]
5E-2FA
 Probe Info  		N.A.  LDD2235  [22]
ATP probe
 Probe Info  		K57(0.00); K59(0.00); K188(0.00)  LDD0199  [23]
4-Iodoacetamidophenylacetylene
 Probe Info  		C32(0.00); C90(0.00); C192(0.00)  LDD0038  [24]
IA-alkyne
 Probe Info  		C90(0.00); C192(0.00)  LDD0032  [25]
IPIAA_H
 Probe Info  		C192(0.00); C90(0.00)  LDD0030  [26]
IPIAA_L
 Probe Info  		C192(0.00); C90(0.00)  LDD0031  [26]
Lodoacetamide azide
 Probe Info  		C32(0.00); C90(0.00); C192(0.00)  LDD0037  [24]
ATP probe
 Probe Info  		N.A.  LDD0035  [27]
JW-RF-010
 Probe Info  		C32(0.00); C112(0.00)  LDD0026  [28]
NAIA_4
 Probe Info  		C192(0.00); 0.00  LDD2226  [29]
TFBX
 Probe Info  		N.A.  LDD0027  [28]
WYneN
 Probe Info  		C192(0.00); C32(0.00)  LDD0021  [30]
WYneO
 Probe Info  		N.A.  LDD0022  [30]
Compound 10
 Probe Info  		C192(0.00); C32(0.00)  LDD2216  [31]
Compound 11
 Probe Info  		N.A.  LDD2213  [31]
ENE
 Probe Info  		N.A.  LDD0006  [30]
IPM
 Probe Info  		C192(0.00); C32(0.00)  LDD0005  [30]
NHS
 Probe Info  		K143(0.00); K160(0.00); K136(0.00); K11(0.00)  LDD0010  [30]
OSF
 Probe Info  		N.A.  LDD0029  [32]
SF
 Probe Info  		K43(0.00); Y108(0.00)  LDD0028  [32]
STPyne
 Probe Info  		K57(0.00); K59(0.00); K143(0.00)  LDD0009  [30]
VSF
 Probe Info  		N.A.  LDD0007  [30]
Phosphinate-6
 Probe Info  		C32(0.00); C112(0.00)  LDD0018  [33]
1c-yne
 Probe Info  		K57(0.00); K100(0.00)  LDD0228  [34]
Acrolein
 Probe Info  		C192(0.00); C32(0.00)  LDD0217  [35]
Cinnamaldehyde
 Probe Info  		N.A.  LDD0220  [35]
Crotonaldehyde
 Probe Info  		N.A.  LDD0219  [35]
Methacrolein
 Probe Info  		N.A.  LDD0218  [35]
W1
 Probe Info  		C192(0.00); C32(0.00); K160(0.00); K161(0.00)  LDD0236  [36]
AOyne
 Probe Info  		15.00  LDD0443  [37]
NAIA_5
 Probe Info  		C237(0.00); C32(0.00); C112(0.00); C192(0.00)  LDD2223  [29]
PAL-AfBPP Probe
Click To Hide/Show 42 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
C010
 Probe Info  		5.94  LDD1719  [38]
C028
 Probe Info  		42.52  LDD1734  [38]
C041
 Probe Info  		7.26  LDD1741  [38]
C055
 Probe Info  		14.72  LDD1752  [38]
C059
 Probe Info  		14.93  LDD1756  [38]
C082
 Probe Info  		5.28  LDD1774  [38]
C158
 Probe Info  		9.78  LDD1838  [38]
C169
 Probe Info  		20.39  LDD1849  [38]
C177
 Probe Info  		17.27  LDD1856  [38]
C186
 Probe Info  		13.83  LDD1864  [38]
C193
 Probe Info  		5.70  LDD1869  [38]
C194
 Probe Info  		9.78  LDD1870  [38]
C212
 Probe Info  		6.77  LDD1886  [38]
C218
 Probe Info  		18.90  LDD1892  [38]
C219
 Probe Info  		4.96  LDD1893  [38]
C240
 Probe Info  		17.63  LDD1913  [38]
C245
 Probe Info  		5.94  LDD1918  [38]
C265
 Probe Info  		36.76  LDD1936  [38]
C275
 Probe Info  		11.16  LDD1945  [38]
C277
 Probe Info  		10.34  LDD1947  [38]
C278
 Probe Info  		85.63  LDD1948  [38]
C288
 Probe Info  		7.06  LDD1958  [38]
C290
 Probe Info  		6.82  LDD1960  [38]
C293
 Probe Info  		33.13  LDD1963  [38]
C317
 Probe Info  		9.65  LDD1983  [38]
C335
 Probe Info  		14.22  LDD1998  [38]
C355
 Probe Info  		30.27  LDD2016  [38]
C356
 Probe Info  		9.58  LDD2017  [38]
C357
 Probe Info  		5.21  LDD2018  [38]
C399
 Probe Info  		11.79  LDD2058  [38]
FFF probe13
 Probe Info  		20.00  LDD0475  [39]
FFF probe14
 Probe Info  		20.00  LDD0477  [39]
FFF probe15
 Probe Info  		6.75  LDD0478  [39]
FFF probe2
 Probe Info  		5.59  LDD0479  [39]
FFF probe3
 Probe Info  		8.93  LDD0480  [39]
FFF probe4
 Probe Info  		13.00  LDD0466  [39]
FFF probe6
 Probe Info  		14.62  LDD0482  [39]
JN0003
 Probe Info  		13.63  LDD0469  [39]
Staurosporine capture compound
 Probe Info  		N.A.  LDD0083  [40]
DA-2
 Probe Info  		N.A.  LDD0070  [41]
OEA-DA
 Probe Info  		11.68  LDD0046  [42]
STS-1
 Probe Info  		N.A.  LDD0068  [43]

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 C192(0.50); C32(0.76)  LDD2142  [9]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C192(0.72); C32(1.17)  LDD2112  [9]
 LDCM0502  1-(Cyanoacetyl)piperidine MDA-MB-231 C192(1.05)  LDD2095  [9]
 LDCM0537  2-Cyano-N,N-dimethylacetamide MDA-MB-231 C192(1.21); C32(0.96)  LDD2130  [9]
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C192(0.84); C32(0.60)  LDD2117  [9]
 LDCM0558  2-Cyano-N-phenylacetamide MDA-MB-231 C192(1.32); C32(0.80)  LDD2152  [9]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C192(1.11); C32(1.28)  LDD2103  [9]
 LDCM0539  3-(4-Isopropylpiperazin-1-yl)-3-oxopropanenitrile MDA-MB-231 C192(0.86)  LDD2132  [9]
 LDCM0538  4-(Cyanoacetyl)morpholine MDA-MB-231 C192(0.72); C32(0.79)  LDD2131  [9]
 LDCM0026  4SU-RNA+native RNA HEK-293T C192(4.39)  LDD0169  [16]
 LDCM0214  AC1 HCT 116 C32(1.43); C192(1.28)  LDD0531  [44]
 LDCM0215  AC10 HCT 116 C32(1.42)  LDD0532  [44]
 LDCM0216  AC100 HCT 116 C32(1.18)  LDD0533  [44]
 LDCM0217  AC101 HCT 116 C32(1.21)  LDD0534  [44]
 LDCM0218  AC102 HCT 116 C32(1.04)  LDD0535  [44]
 LDCM0219  AC103 HCT 116 C32(1.19)  LDD0536  [44]
 LDCM0220  AC104 HCT 116 C32(1.10)  LDD0537  [44]
 LDCM0221  AC105 HCT 116 C32(1.34)  LDD0538  [44]
 LDCM0222  AC106 HCT 116 C32(1.34)  LDD0539  [44]
 LDCM0223  AC107 HCT 116 C32(1.13)  LDD0540  [44]
 LDCM0224  AC108 HCT 116 C32(1.05)  LDD0541  [44]
 LDCM0225  AC109 HCT 116 C32(1.20)  LDD0542  [44]
 LDCM0226  AC11 HCT 116 C32(1.55)  LDD0543  [44]
 LDCM0227  AC110 HCT 116 C32(0.98)  LDD0544  [44]
 LDCM0228  AC111 HCT 116 C32(1.17)  LDD0545  [44]
 LDCM0229  AC112 HCT 116 C32(1.11)  LDD0546  [44]
 LDCM0230  AC113 HCT 116 C32(1.26)  LDD0547  [44]
 LDCM0231  AC114 HCT 116 C32(1.18)  LDD0548  [44]
 LDCM0232  AC115 HCT 116 C32(1.23)  LDD0549  [44]
 LDCM0233  AC116 HCT 116 C32(1.62)  LDD0550  [44]
 LDCM0234  AC117 HCT 116 C32(1.37)  LDD0551  [44]
 LDCM0235  AC118 HCT 116 C32(1.22)  LDD0552  [44]
 LDCM0236  AC119 HCT 116 C32(1.06)  LDD0553  [44]
 LDCM0237  AC12 HCT 116 C32(1.40)  LDD0554  [44]
 LDCM0238  AC120 HCT 116 C32(1.13)  LDD0555  [44]
 LDCM0239  AC121 HCT 116 C32(1.16)  LDD0556  [44]
 LDCM0240  AC122 HCT 116 C32(1.00)  LDD0557  [44]
 LDCM0241  AC123 HCT 116 C32(1.11)  LDD0558  [44]
 LDCM0242  AC124 HCT 116 C32(0.88)  LDD0559  [44]
 LDCM0243  AC125 HCT 116 C32(1.38)  LDD0560  [44]
 LDCM0244  AC126 HCT 116 C32(1.38)  LDD0561  [44]
 LDCM0245  AC127 HCT 116 C32(1.21)  LDD0562  [44]
 LDCM0246  AC128 HCT 116 C32(1.31)  LDD0563  [44]
 LDCM0247  AC129 HCT 116 C32(1.61)  LDD0564  [44]
 LDCM0249  AC130 HCT 116 C32(1.35)  LDD0566  [44]
 LDCM0250  AC131 HCT 116 C32(1.28)  LDD0567  [44]
 LDCM0251  AC132 HCT 116 C32(1.22)  LDD0568  [44]
 LDCM0252  AC133 HCT 116 C32(1.23)  LDD0569  [44]
 LDCM0253  AC134 HCT 116 C32(1.47)  LDD0570  [44]
 LDCM0254  AC135 HCT 116 C32(1.18)  LDD0571  [44]
 LDCM0255  AC136 HCT 116 C32(1.38)  LDD0572  [44]
 LDCM0256  AC137 HCT 116 C32(1.36)  LDD0573  [44]
 LDCM0257  AC138 HCT 116 C32(1.52)  LDD0574  [44]
 LDCM0258  AC139 HCT 116 C32(1.54)  LDD0575  [44]
 LDCM0259  AC14 HCT 116 C32(1.09)  LDD0576  [44]
 LDCM0260  AC140 HCT 116 C32(1.78)  LDD0577  [44]
 LDCM0261  AC141 HCT 116 C32(1.51)  LDD0578  [44]
 LDCM0262  AC142 HCT 116 C32(1.22)  LDD0579  [44]
 LDCM0263  AC143 HCT 116 C32(1.26); C192(1.05)  LDD0580  [44]
 LDCM0264  AC144 HCT 116 C192(1.06); C32(1.36)  LDD0581  [44]
 LDCM0265  AC145 HCT 116 C192(0.99); C32(1.28)  LDD0582  [44]
 LDCM0266  AC146 HCT 116 C192(0.99); C32(1.41)  LDD0583  [44]
 LDCM0267  AC147 HCT 116 C192(1.05); C32(1.41)  LDD0584  [44]
 LDCM0268  AC148 HCT 116 C192(1.00); C32(1.64)  LDD0585  [44]
 LDCM0269  AC149 HCT 116 C192(1.15); C32(1.69)  LDD0586  [44]
 LDCM0270  AC15 HCT 116 C32(1.37)  LDD0587  [44]
 LDCM0271  AC150 HCT 116 C192(0.99); C32(1.17)  LDD0588  [44]
 LDCM0272  AC151 HCT 116 C192(1.03); C32(1.12)  LDD0589  [44]
 LDCM0273  AC152 HCT 116 C192(1.07); C32(1.36)  LDD0590  [44]
 LDCM0274  AC153 HCT 116 C192(0.84); C32(1.75)  LDD0591  [44]
 LDCM0621  AC154 HCT 116 C32(1.32); C192(1.13)  LDD2158  [44]
 LDCM0622  AC155 HCT 116 C32(0.95); C192(1.09)  LDD2159  [44]
 LDCM0623  AC156 HCT 116 C32(0.86); C192(1.09)  LDD2160  [44]
 LDCM0624  AC157 HCT 116 C32(0.69); C192(0.90)  LDD2161  [44]
 LDCM0276  AC17 HCT 116 C192(0.73); C32(2.12)  LDD0593  [44]
 LDCM0277  AC18 HCT 116 C32(1.30); C192(1.30)  LDD0594  [44]
 LDCM0278  AC19 HCT 116 C32(0.84); C192(1.02)  LDD0595  [44]
 LDCM0279  AC2 HCT 116 C32(1.25); C192(1.32)  LDD0596  [44]
 LDCM0280  AC20 HCT 116 C192(0.97); C32(1.00)  LDD0597  [44]
 LDCM0281  AC21 HCT 116 C192(0.95); C32(1.08)  LDD0598  [44]
 LDCM0282  AC22 HCT 116 C192(0.87); C32(1.18)  LDD0599  [44]
 LDCM0283  AC23 HCT 116 C32(0.68); C192(0.76)  LDD0600  [44]
 LDCM0284  AC24 HCT 116 C32(0.86); C192(0.90)  LDD0601  [44]
 LDCM0285  AC25 HCT 116 C192(1.13); C32(1.44)  LDD0602  [44]
 LDCM0286  AC26 HCT 116 C192(1.22); C32(1.24)  LDD0603  [44]
 LDCM0287  AC27 HCT 116 C192(1.25); C32(1.29)  LDD0604  [44]
 LDCM0288  AC28 HCT 116 C192(1.17); C32(1.28)  LDD0605  [44]
 LDCM0289  AC29 HCT 116 C192(1.22); C32(1.22)  LDD0606  [44]
 LDCM0290  AC3 HCT 116 C192(1.14); C32(1.24)  LDD0607  [44]
 LDCM0291  AC30 HCT 116 C192(1.31); C32(1.57)  LDD0608  [44]
 LDCM0292  AC31 HCT 116 C192(1.28); C32(1.50)  LDD0609  [44]
 LDCM0293  AC32 HCT 116 C192(1.38); C32(1.92)  LDD0610  [44]
 LDCM0294  AC33 HCT 116 C192(1.24); C32(1.48)  LDD0611  [44]
 LDCM0295  AC34 HCT 116 C192(1.20); C32(1.58)  LDD0612  [44]
 LDCM0296  AC35 HCT 116 C192(1.04); C32(1.05)  LDD0613  [44]
 LDCM0297  AC36 HCT 116 C192(1.08); C32(1.15)  LDD0614  [44]
 LDCM0298  AC37 HCT 116 C32(1.01); C192(1.26)  LDD0615  [44]
 LDCM0299  AC38 HCT 116 C192(1.04); C32(1.12)  LDD0616  [44]
 LDCM0300  AC39 HCT 116 C192(1.19); C32(1.30)  LDD0617  [44]
 LDCM0301  AC4 HCT 116 C32(1.27); C192(1.28)  LDD0618  [44]
 LDCM0302  AC40 HCT 116 C192(0.87); C32(1.48)  LDD0619  [44]
 LDCM0303  AC41 HCT 116 C192(1.14); C32(1.24)  LDD0620  [44]
 LDCM0304  AC42 HCT 116 C192(1.08); C32(1.43)  LDD0621  [44]
 LDCM0305  AC43 HCT 116 C192(1.07); C32(1.33)  LDD0622  [44]
 LDCM0306  AC44 HCT 116 C192(1.03); C32(1.25)  LDD0623  [44]
 LDCM0307  AC45 HCT 116 C192(0.88); C32(1.60)  LDD0624  [44]
 LDCM0308  AC46 HCT 116 C192(0.99); C32(1.11)  LDD0625  [44]
 LDCM0309  AC47 HCT 116 C192(1.36); C32(3.73)  LDD0626  [44]
 LDCM0310  AC48 HCT 116 C192(1.13); C32(1.16)  LDD0627  [44]
 LDCM0311  AC49 HCT 116 C192(0.97); C32(1.34)  LDD0628  [44]
 LDCM0312  AC5 HCT 116 C192(1.29); C32(1.57)  LDD0629  [44]
 LDCM0313  AC50 HCT 116 C192(0.90); C32(1.38)  LDD0630  [44]
 LDCM0314  AC51 HCT 116 C192(1.00); C32(1.13)  LDD0631  [44]
 LDCM0315  AC52 HCT 116 C192(1.07); C32(1.23)  LDD0632  [44]
 LDCM0316  AC53 HCT 116 C192(0.57); C32(4.94)  LDD0633  [44]
 LDCM0317  AC54 HCT 116 C192(1.11); C32(1.19)  LDD0634  [44]
 LDCM0318  AC55 HCT 116 C192(0.90); C32(1.05)  LDD0635  [44]
 LDCM0319  AC56 HCT 116 C192(0.19); C32(1.66)  LDD0636  [44]
 LDCM0320  AC57 HCT 116 C192(0.92); C32(1.37)  LDD0637  [44]
 LDCM0321  AC58 HCT 116 C192(1.03); C32(1.48)  LDD0638  [44]
 LDCM0322  AC59 HCT 116 C192(0.95); C32(1.78)  LDD0639  [44]
 LDCM0323  AC6 HCT 116 C32(4.19)  LDD0640  [44]
 LDCM0324  AC60 HCT 116 C192(0.95); C32(1.48)  LDD0641  [44]
 LDCM0325  AC61 HCT 116 C192(1.01); C32(1.55)  LDD0642  [44]
 LDCM0326  AC62 HCT 116 C192(0.94); C32(1.70)  LDD0643  [44]
 LDCM0327  AC63 HCT 116 C192(0.55); C32(2.64)  LDD0644  [44]
 LDCM0328  AC64 HCT 116 C192(0.88); C32(1.64)  LDD0645  [44]
 LDCM0329  AC65 HCT 116 C192(1.27); C32(2.27)  LDD0646  [44]
 LDCM0330  AC66 HCT 116 C192(1.08); C32(2.13)  LDD0647  [44]
 LDCM0331  AC67 HCT 116 C192(1.03); C32(1.60)  LDD0648  [44]
 LDCM0332  AC68 HCT 116 C192(0.96); C32(1.38)  LDD0649  [44]
 LDCM0333  AC69 HCT 116 C192(0.92); C32(1.55)  LDD0650  [44]
 LDCM0334  AC7 HCT 116 C32(1.69)  LDD0651  [44]
 LDCM0335  AC70 HCT 116 C192(0.87); C32(1.39)  LDD0652  [44]
 LDCM0336  AC71 HCT 116 C192(0.81); C32(1.41)  LDD0653  [44]
 LDCM0337  AC72 HCT 116 C192(0.90); C32(2.15)  LDD0654  [44]
 LDCM0338  AC73 HCT 116 C192(0.73); C32(1.58)  LDD0655  [44]
 LDCM0339  AC74 HCT 116 C192(0.67); C32(1.70)  LDD0656  [44]
 LDCM0340  AC75 HCT 116 C192(0.69); C32(1.09)  LDD0657  [44]
 LDCM0341  AC76 HCT 116 C192(0.87); C32(1.45)  LDD0658  [44]
 LDCM0342  AC77 HCT 116 C192(0.94); C32(1.48)  LDD0659  [44]
 LDCM0343  AC78 HCT 116 C192(0.99); C32(1.38)  LDD0660  [44]
 LDCM0344  AC79 HCT 116 C192(0.92); C32(1.51)  LDD0661  [44]
 LDCM0345  AC8 HCT 116 C32(1.78)  LDD0662  [44]
 LDCM0346  AC80 HCT 116 C192(0.96); C32(1.34)  LDD0663  [44]
 LDCM0347  AC81 HCT 116 C192(0.78); C32(1.32)  LDD0664  [44]
 LDCM0348  AC82 HCT 116 C192(0.53); C32(0.77)  LDD0665  [44]
 LDCM0349  AC83 HCT 116 C192(1.13); C32(1.22)  LDD0666  [44]
 LDCM0350  AC84 HCT 116 C192(0.72); C32(1.18)  LDD0667  [44]
 LDCM0351  AC85 HCT 116 C192(1.13); C32(2.64)  LDD0668  [44]
 LDCM0352  AC86 HCT 116 C192(1.40); C32(3.27)  LDD0669  [44]
 LDCM0353  AC87 HCT 116 C32(0.92); C192(1.08)  LDD0670  [44]
 LDCM0354  AC88 HCT 116 C32(1.07); C192(1.12)  LDD0671  [44]
 LDCM0355  AC89 HCT 116 C32(0.88); C192(1.18)  LDD0672  [44]
 LDCM0357  AC90 HCT 116 C32(1.08); C192(1.24)  LDD0674  [44]
 LDCM0358  AC91 HCT 116 C32(1.10); C192(1.13)  LDD0675  [44]
 LDCM0359  AC92 HCT 116 C192(1.02); C32(1.20)  LDD0676  [44]
 LDCM0360  AC93 HCT 116 C192(1.03); C32(1.04)  LDD0677  [44]
 LDCM0361  AC94 HCT 116 C32(1.03); C192(1.17)  LDD0678  [44]
 LDCM0362  AC95 HCT 116 C192(1.00); C32(1.01)  LDD0679  [44]
 LDCM0363  AC96 HCT 116 C192(1.06); C32(1.44)  LDD0680  [44]
 LDCM0364  AC97 HCT 116 C192(1.22); C32(1.64)  LDD0681  [44]
 LDCM0365  AC98 HCT 116 C32(0.87)  LDD0682  [44]
 LDCM0366  AC99 HCT 116 C32(1.33)  LDD0683  [44]
 LDCM0545  Acetamide MDA-MB-231 C192(0.56)  LDD2138  [9]
 LDCM0520  AKOS000195272 MDA-MB-231 C192(0.73); C32(0.72)  LDD2113  [9]
 LDCM0248  AKOS034007472 HCT 116 C32(1.06)  LDD0565  [44]
 LDCM0356  AKOS034007680 HCT 116 C32(1.68)  LDD0673  [44]
 LDCM0275  AKOS034007705 HCT 116 C32(1.45)  LDD0592  [44]
 LDCM0156  Aniline NCI-H1299 14.91  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C32(1.05)  LDD2171  [44]
 LDCM0498  BS-3668 MDA-MB-231 C192(0.72); C32(0.67); C112(0.85)  LDD2091  [9]
 LDCM0089  C30 HEK-293T 1.31  LDD0210  [10]
 LDCM0088  C45 HEK-293T 6.51  LDD0203  [10]
 LDCM0630  CCW28-3 231MFP C237(1.15); C90(1.05)  LDD2214  [45]
 LDCM0108  Chloroacetamide HeLa C192(0.00); H49(0.00)  LDD0222  [35]
 LDCM0071  Cisar_cp14 MDA-MB-231 6.00  LDD0121  [13]
 LDCM0070  Cisar_cp37 MDA-MB-231 3.01  LDD0120  [13]
 LDCM0632  CL-Sc Hep-G2 C192(1.24); C192(0.86); C32(0.37)  LDD2227  [29]
 LDCM0367  CL1 HCT 116 C192(0.77); C32(11.13)  LDD0684  [44]
 LDCM0368  CL10 HCT 116 C192(0.54); C32(11.22)  LDD0685  [44]
 LDCM0369  CL100 HCT 116 C192(0.99); C32(2.29)  LDD0686  [44]
 LDCM0370  CL101 HCT 116 C32(8.92)  LDD0687  [44]
 LDCM0371  CL102 HCT 116 C32(16.66)  LDD0688  [44]
 LDCM0372  CL103 HCT 116 C32(17.52)  LDD0689  [44]
 LDCM0373  CL104 HCT 116 C32(9.43)  LDD0690  [44]
 LDCM0374  CL105 HCT 116 C192(0.83); C32(12.44)  LDD0691  [44]
 LDCM0375  CL106 HCT 116 C192(0.78); C32(3.32)  LDD0692  [44]
 LDCM0376  CL107 HCT 116 C192(1.09); C32(1.69)  LDD0693  [44]
 LDCM0377  CL108 HCT 116 C192(0.51); C32(3.22)  LDD0694  [44]
 LDCM0378  CL109 HCT 116 C192(0.74); C32(13.14)  LDD0695  [44]
 LDCM0379  CL11 HCT 116 C192(0.41); C32(12.13)  LDD0696  [44]
 LDCM0380  CL110 HCT 116 C192(0.57); C32(14.06)  LDD0697  [44]
 LDCM0381  CL111 HCT 116 C192(0.63); C32(16.99)  LDD0698  [44]
 LDCM0382  CL112 HCT 116 C192(0.92); C32(8.93)  LDD0699  [44]
 LDCM0383  CL113 HCT 116 C192(1.22); C32(1.58)  LDD0700  [44]
 LDCM0384  CL114 HCT 116 C192(0.79); C32(6.23)  LDD0701  [44]
 LDCM0385  CL115 HCT 116 C192(0.79); C32(5.42)  LDD0702  [44]
 LDCM0386  CL116 HCT 116 C192(1.40); C32(6.21)  LDD0703  [44]
 LDCM0387  CL117 HCT 116 C192(0.20); C32(10.72)  LDD0704  [44]
 LDCM0388  CL118 HCT 116 C192(0.80); C32(1.55)  LDD0705  [44]
 LDCM0389  CL119 HCT 116 C192(0.84); C32(1.89)  LDD0706  [44]
 LDCM0390  CL12 HCT 116 C192(0.45); C32(14.14)  LDD0707  [44]
 LDCM0391  CL120 HCT 116 C192(0.97); C32(2.30)  LDD0708  [44]
 LDCM0392  CL121 HCT 116 C192(0.75); C32(2.20)  LDD0709  [44]
 LDCM0393  CL122 HCT 116 C192(0.52); C32(12.39)  LDD0710  [44]
 LDCM0394  CL123 HCT 116 C192(0.22); C32(8.96)  LDD0711  [44]
 LDCM0395  CL124 HCT 116 C192(0.20); C32(9.11)  LDD0712  [44]
 LDCM0396  CL125 HCT 116 C192(1.04); C32(3.91)  LDD0713  [44]
 LDCM0397  CL126 HCT 116 C192(1.15); C32(20.00)  LDD0714  [44]
 LDCM0398  CL127 HCT 116 C192(1.15); C32(5.07)  LDD0715  [44]
 LDCM0399  CL128 HCT 116 C192(1.14); C32(2.91)  LDD0716  [44]
 LDCM0400  CL13 HCT 116 C192(0.49); C32(8.00)  LDD0717  [44]
 LDCM0401  CL14 HCT 116 C192(0.51); C32(7.33)  LDD0718  [44]
 LDCM0402  CL15 HCT 116 C192(0.48); C32(7.37)  LDD0719  [44]
 LDCM0403  CL16 HCT 116 C192(1.07); C32(3.20)  LDD0720  [44]
 LDCM0404  CL17 HCT 116 C192(0.61); C32(2.34)  LDD0721  [44]
 LDCM0405  CL18 HCT 116 C192(1.28); C32(2.23)  LDD0722  [44]
 LDCM0406  CL19 HCT 116 C192(0.77); C32(5.69)  LDD0723  [44]
 LDCM0407  CL2 HCT 116 C192(0.68); C32(13.37)  LDD0724  [44]
 LDCM0408  CL20 HCT 116 C32(1.12); C192(1.14)  LDD0725  [44]
 LDCM0409  CL21 HCT 116 C192(0.73); C32(1.36)  LDD0726  [44]
 LDCM0410  CL22 HCT 116 C192(0.32); C32(6.23)  LDD0727  [44]
 LDCM0411  CL23 HCT 116 C192(1.43); C32(1.55)  LDD0728  [44]
 LDCM0412  CL24 HCT 116 C192(1.03); C32(1.32)  LDD0729  [44]
 LDCM0413  CL25 HCT 116 C32(5.51); C192(0.54)  LDD0730  [44]
 LDCM0414  CL26 HCT 116 C32(1.85); C192(0.74)  LDD0731  [44]
 LDCM0415  CL27 HCT 116 C32(6.31); C192(1.17)  LDD0732  [44]
 LDCM0416  CL28 HCT 116 C32(5.28); C192(0.54)  LDD0733  [44]
 LDCM0417  CL29 HCT 116 C32(7.54); C192(0.61)  LDD0734  [44]
 LDCM0418  CL3 HCT 116 C32(9.82); C192(0.73)  LDD0735  [44]
 LDCM0419  CL30 HCT 116 C32(3.27); C192(0.68)  LDD0736  [44]
 LDCM0420  CL31 HCT 116 C32(2.09); C192(0.87)  LDD0737  [44]
 LDCM0421  CL32 HCT 116 C32(3.22); C192(0.80)  LDD0738  [44]
 LDCM0422  CL33 HCT 116 C32(3.86); C192(0.59)  LDD0739  [44]
 LDCM0423  CL34 HCT 116 C32(2.22); C192(0.57)  LDD0740  [44]
 LDCM0424  CL35 HCT 116 C32(2.90); C192(0.57)  LDD0741  [44]
 LDCM0425  CL36 HCT 116 C32(3.38); C192(0.55)  LDD0742  [44]
 LDCM0426  CL37 HCT 116 C32(1.10); C192(0.43)  LDD0743  [44]
 LDCM0428  CL39 HCT 116 C32(1.18); C192(0.41)  LDD0745  [44]
 LDCM0429  CL4 HCT 116 C32(12.12); C192(0.59)  LDD0746  [44]
 LDCM0430  CL40 HCT 116 C32(3.14); C192(0.67)  LDD0747  [44]
 LDCM0431  CL41 HCT 116 C32(2.68); C192(0.67)  LDD0748  [44]
 LDCM0432  CL42 HCT 116 C32(0.98); C192(0.46)  LDD0749  [44]
 LDCM0433  CL43 HCT 116 C32(3.51); C192(0.46)  LDD0750  [44]
 LDCM0434  CL44 HCT 116 C32(1.28); C192(0.54)  LDD0751  [44]
 LDCM0435  CL45 HCT 116 C32(2.16); C192(0.53)  LDD0752  [44]
 LDCM0436  CL46 HCT 116 C32(11.95); C192(0.92)  LDD0753  [44]
 LDCM0437  CL47 HCT 116 C32(4.99); C192(0.70)  LDD0754  [44]
 LDCM0438  CL48 HCT 116 C32(11.70); C192(0.82)  LDD0755  [44]
 LDCM0439  CL49 HCT 116 C32(2.46); C192(0.59)  LDD0756  [44]
 LDCM0440  CL5 HCT 116 C32(1.81); C192(0.89)  LDD0757  [44]
 LDCM0441  CL50 HCT 116 C32(11.92); C192(0.74)  LDD0758  [44]
 LDCM0442  CL51 HCT 116 C32(7.99); C192(1.07)  LDD0759  [44]
 LDCM0443  CL52 HCT 116 C32(3.46); C192(0.83)  LDD0760  [44]
 LDCM0444  CL53 HCT 116 C32(8.41); C192(0.64)  LDD0761  [44]
 LDCM0445  CL54 HCT 116 C32(11.03); C192(0.64)  LDD0762  [44]
 LDCM0446  CL55 HCT 116 C32(2.55); C192(0.81)  LDD0763  [44]
 LDCM0447  CL56 HCT 116 C32(1.76); C192(0.62)  LDD0764  [44]
 LDCM0448  CL57 HCT 116 C32(10.88); C192(0.67)  LDD0765  [44]
 LDCM0449  CL58 HCT 116 C32(11.12); C192(0.74)  LDD0766  [44]
 LDCM0450  CL59 HCT 116 C32(2.98); C192(0.77)  LDD0767  [44]
 LDCM0451  CL6 HCT 116 C32(7.38); C192(0.70)  LDD0768  [44]
 LDCM0452  CL60 HCT 116 C32(11.24); C192(0.61)  LDD0769  [44]
 LDCM0453  CL61 HCT 116 C32(3.76); C192(1.08)  LDD0770  [44]
 LDCM0454  CL62 HCT 116 C32(13.45); C192(0.95)  LDD0771  [44]
 LDCM0455  CL63 HCT 116 C32(7.00); C192(0.76)  LDD0772  [44]
 LDCM0456  CL64 HCT 116 C32(11.23); C192(0.80)  LDD0773  [44]
 LDCM0457  CL65 HCT 116 C32(2.55); C192(0.92)  LDD0774  [44]
 LDCM0458  CL66 HCT 116 C32(13.25); C192(0.92)  LDD0775  [44]
 LDCM0459  CL67 HCT 116 C32(5.84); C192(0.98)  LDD0776  [44]
 LDCM0460  CL68 HCT 116 C32(12.85); C192(0.94)  LDD0777  [44]
 LDCM0461  CL69 HCT 116 C32(13.48); C192(0.82)  LDD0778  [44]
 LDCM0462  CL7 HCT 116 C32(16.17); C192(0.54)  LDD0779  [44]
 LDCM0463  CL70 HCT 116 C32(11.94); C192(0.75)  LDD0780  [44]
 LDCM0464  CL71 HCT 116 C32(4.19); C192(0.96)  LDD0781  [44]
 LDCM0465  CL72 HCT 116 C32(2.00); C192(0.99)  LDD0782  [44]
 LDCM0466  CL73 HCT 116 C32(13.13); C192(0.60)  LDD0783  [44]
 LDCM0467  CL74 HCT 116 C32(5.90); C192(0.99)  LDD0784  [44]
 LDCM0469  CL76 HCT 116 C32(10.36); C192(0.78)  LDD0786  [44]
 LDCM0470  CL77 HCT 116 C32(11.66); C192(0.78)  LDD0787  [44]
 LDCM0471  CL78 HCT 116 C32(4.62); C192(1.03)  LDD0788  [44]
 LDCM0472  CL79 HCT 116 C32(2.26); C192(0.62)  LDD0789  [44]
 LDCM0473  CL8 HCT 116 C32(7.28); C192(0.41)  LDD0790  [44]
 LDCM0474  CL80 HCT 116 C32(2.38); C192(0.88)  LDD0791  [44]
 LDCM0475  CL81 HCT 116 C32(6.08); C192(0.77)  LDD0792  [44]
 LDCM0476  CL82 HCT 116 C32(6.21); C192(0.48)  LDD0793  [44]
 LDCM0477  CL83 HCT 116 C32(11.89); C192(0.39)  LDD0794  [44]
 LDCM0478  CL84 HCT 116 C32(11.28); C192(0.30)  LDD0795  [44]
 LDCM0479  CL85 HCT 116 C32(5.64); C192(0.88)  LDD0796  [44]
 LDCM0480  CL86 HCT 116 C32(2.50); C192(1.26)  LDD0797  [44]
 LDCM0481  CL87 HCT 116 C32(11.52); C192(1.59)  LDD0798  [44]
 LDCM0482  CL88 HCT 116 C32(16.48); C192(0.44)  LDD0799  [44]
 LDCM0483  CL89 HCT 116 C32(9.71); C192(0.29)  LDD0800  [44]
 LDCM0484  CL9 HCT 116 C32(13.65); C192(0.63)  LDD0801  [44]
 LDCM0485  CL90 HCT 116 C32(8.51); C192(0.59)  LDD0802  [44]
 LDCM0486  CL91 HCT 116 C32(6.14); C192(0.69)  LDD0803  [44]
 LDCM0487  CL92 HCT 116 C32(8.27); C192(0.98)  LDD0804  [44]
 LDCM0488  CL93 HCT 116 C32(7.84); C192(0.87)  LDD0805  [44]
 LDCM0489  CL94 HCT 116 C32(10.39); C192(0.79)  LDD0806  [44]
 LDCM0490  CL95 HCT 116 C32(12.56); C192(0.83)  LDD0807  [44]
 LDCM0491  CL96 HCT 116 C32(11.14); C192(1.02)  LDD0808  [44]
 LDCM0492  CL97 HCT 116 C32(8.82); C192(0.90)  LDD0809  [44]
 LDCM0493  CL98 HCT 116 C32(9.67); C192(1.06)  LDD0810  [44]
 LDCM0494  CL99 HCT 116 C32(6.51); C192(1.26)  LDD0811  [44]
 LDCM0634  CY-0357 Hep-G2 C237(3.74); C32(2.28); C192(0.94)  LDD2228  [29]
 LDCM0495  E2913 HEK-293T C192(0.91); C32(8.17); C90(0.49); C237(0.92)  LDD1698  [46]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C192(0.94); C32(0.93)  LDD1702  [9]
 LDCM0100  EN219 231MFP 3.52  LDD0298  [12]
 LDCM0201  EV-3 T cell C32(5.77)  LDD0515  [47]
 LDCM0202  EV-93 T cell C32(7.42)  LDD0514  [47]
 LDCM0205  EV-98 T cell C32(9.93)  LDD0519  [47]
 LDCM0206  EV-99 T cell C32(17.67)  LDD0521  [47]
 LDCM0625  F8 Ramos C192(1.54); C112(1.39); C32(1.03)  LDD2187  [48]
 LDCM0572  Fragment10 MDA-MB-231 C32(20.00)  LDD1389  [14]
 LDCM0573  Fragment11 MDA-MB-231 C32(20.00)  LDD1391  [14]
 LDCM0574  Fragment12 Ramos C32(20.00)  LDD1394  [14]
 LDCM0575  Fragment13 MDA-MB-231 C32(20.00)  LDD1395  [14]
 LDCM0576  Fragment14 MDA-MB-231 C32(1.15)  LDD1397  [14]
 LDCM0577  Fragment15 Ramos C32(0.82)  LDD1400  [14]
 LDCM0579  Fragment20 MDA-MB-231 C32(20.00)  LDD1402  [14]
 LDCM0580  Fragment21 MDA-MB-231 C32(20.00)  LDD1404  [14]
 LDCM0581  Fragment22 MDA-MB-231 C32(20.00)  LDD1406  [14]
 LDCM0582  Fragment23 MDA-MB-231 C32(0.90)  LDD1408  [14]
 LDCM0583  Fragment24 Ramos C32(12.55)  LDD1410  [14]
 LDCM0584  Fragment25 MDA-MB-231 C32(2.78)  LDD1411  [14]
 LDCM0585  Fragment26 Ramos C32(0.83)  LDD1412  [14]
 LDCM0578  Fragment27 MDA-MB-231 C32(1.96)  LDD1401  [14]
 LDCM0586  Fragment28 MDA-MB-231 C32(20.00)  LDD1415  [14]
 LDCM0587  Fragment29 MDA-MB-231 C32(1.65)  LDD1417  [14]
 LDCM0588  Fragment30 MDA-MB-231 C32(20.00)  LDD1419  [14]
 LDCM0589  Fragment31 MDA-MB-231 C32(3.62)  LDD1421  [14]
 LDCM0590  Fragment32 MDA-MB-231 C32(20.00)  LDD1423  [14]
 LDCM0468  Fragment33 HCT 116 C32(10.60); C192(0.79)  LDD0785  [44]
 LDCM0592  Fragment34 MDA-MB-231 C32(20.00)  LDD1427  [14]
 LDCM0593  Fragment35 Ramos C32(1.52)  LDD1430  [14]
 LDCM0594  Fragment36 MDA-MB-231 C32(20.00)  LDD1431  [14]
 LDCM0595  Fragment37 Ramos C32(1.27)  LDD1432  [14]
 LDCM0596  Fragment38 MDA-MB-231 C32(1.21)  LDD1433  [14]
 LDCM0597  Fragment39 MDA-MB-231 C32(20.00)  LDD1435  [14]
 LDCM0566  Fragment4 MDA-MB-231 C32(20.00)  LDD1378  [14]
 LDCM0598  Fragment40 MDA-MB-231 C32(0.93)  LDD1436  [14]
 LDCM0599  Fragment41 MDA-MB-231 C32(0.88)  LDD1438  [14]
 LDCM0600  Fragment42 Ramos C32(1.01)  LDD1440  [14]
 LDCM0601  Fragment43 MDA-MB-231 C32(20.00)  LDD1441  [14]
 LDCM0602  Fragment44 MDA-MB-231 C32(0.50)  LDD1443  [14]
 LDCM0603  Fragment45 MDA-MB-231 C32(1.93)  LDD1482  [14]
 LDCM0604  Fragment46 MDA-MB-231 C32(0.89)  LDD1445  [14]
 LDCM0605  Fragment47 MDA-MB-231 C32(1.15)  LDD1446  [14]
 LDCM0606  Fragment48 MDA-MB-231 C32(1.12)  LDD1447  [14]
 LDCM0607  Fragment49 MDA-MB-231 C32(20.00)  LDD1448  [14]
 LDCM0608  Fragment50 MDA-MB-231 C32(20.00)  LDD1449  [14]
 LDCM0427  Fragment51 HCT 116 C32(3.12); C192(0.28)  LDD0744  [44]
 LDCM0610  Fragment52 MDA-MB-231 C32(6.81)  LDD1452  [14]
 LDCM0611  Fragment53 MDA-MB-231 C32(2.06)  LDD1454  [14]
 LDCM0612  Fragment54 MDA-MB-231 C32(20.00)  LDD1456  [14]
 LDCM0613  Fragment55 MDA-MB-231 C32(20.00)  LDD1457  [14]
 LDCM0614  Fragment56 MDA-MB-231 C32(1.29)  LDD1458  [14]
 LDCM0568  Fragment6 MDA-MB-231 C32(1.10)  LDD1382  [14]
 LDCM0616  Fragment61 Jurkat _(20.00)  LDD1489  [14]
 LDCM0615  Fragment63-R Jurkat _(20.00)  LDD1487  [14]
 LDCM0617  Fragment63-S Jurkat _(20.00)  LDD1490  [14]
 LDCM0569  Fragment7 MDA-MB-231 C32(20.00)  LDD1383  [14]
 LDCM0570  Fragment8 MDA-MB-231 C32(19.94)  LDD1385  [14]
 LDCM0571  Fragment9 MDA-MB-231 C32(20.00)  LDD1387  [14]
 LDCM0116  HHS-0101 DM93 Y139(1.20)  LDD0264  [19]
 LDCM0117  HHS-0201 DM93 Y139(0.80)  LDD0265  [19]
 LDCM0118  HHS-0301 DM93 Y139(0.92)  LDD0266  [19]
 LDCM0119  HHS-0401 DM93 Y139(0.99)  LDD0267  [19]
 LDCM0120  HHS-0701 DM93 Y139(1.04)  LDD0268  [19]
 LDCM0015  HNE MDA-MB-231 0.97  LDD0346  [48]
 LDCM0107  IAA HeLa H49(0.00); C192(0.00); H195(0.00)  LDD0221  [35]
 LDCM0123  JWB131 DM93 Y139(0.97)  LDD0285  [18]
 LDCM0124  JWB142 DM93 Y139(1.22)  LDD0286  [18]
 LDCM0125  JWB146 DM93 Y139(0.83)  LDD0287  [18]
 LDCM0126  JWB150 DM93 Y139(2.09)  LDD0288  [18]
 LDCM0127  JWB152 DM93 Y139(1.60)  LDD0289  [18]
 LDCM0128  JWB198 DM93 Y139(0.28)  LDD0290  [18]
 LDCM0129  JWB202 DM93 Y139(0.82)  LDD0291  [18]
 LDCM0130  JWB211 DM93 Y139(0.66)  LDD0292  [18]
 LDCM0022  KB02 MDA-MB-231 C32(19.54)  LDD1374  [14]
 LDCM0023  KB03 Jurkat C32(95.41)  LDD0209  [17]
 LDCM0024  KB05 COLO792 C192(0.90)  LDD3310  [49]
 LDCM0169  KB63 Ramos 20.00  LDD0432  [50]
 LDCM0509  N-(4-bromo-3,5-dimethylphenyl)-2-nitroacetamide MDA-MB-231 C192(0.97); C32(1.13)  LDD2102  [9]
 LDCM0528  N-(4-bromophenyl)-2-cyano-N-phenylacetamide MDA-MB-231 C192(0.90); C32(0.79)  LDD2121  [9]
 LDCM0109  NEM HeLa H49(0.00); H195(0.00)  LDD0223  [35]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C192(0.75); C32(1.00)  LDD2089  [9]
 LDCM0497  Nucleophilic fragment 11b MDA-MB-231 C192(0.97); C32(1.56)  LDD2090  [9]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C192(1.30); C32(0.97)  LDD2092  [9]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C192(0.89); C32(1.19)  LDD2093  [9]
 LDCM0501  Nucleophilic fragment 13b MDA-MB-231 C192(2.80); C32(1.25)  LDD2094  [9]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C192(0.27)  LDD2096  [9]
 LDCM0504  Nucleophilic fragment 15a MDA-MB-231 C192(0.81); C32(1.00)  LDD2097  [9]
 LDCM0505  Nucleophilic fragment 15b MDA-MB-231 C192(0.88); C32(1.10)  LDD2098  [9]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C192(0.87); C32(0.71)  LDD2099  [9]
 LDCM0507  Nucleophilic fragment 16b MDA-MB-231 C192(0.45); C32(0.87)  LDD2100  [9]
 LDCM0508  Nucleophilic fragment 17a MDA-MB-231 C192(1.05); C32(0.80)  LDD2101  [9]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C192(0.49); C32(0.93)  LDD2104  [9]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C192(1.46); C32(1.45)  LDD2105  [9]
 LDCM0513  Nucleophilic fragment 19b MDA-MB-231 C192(0.40); C32(1.08)  LDD2106  [9]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C192(0.69); C32(0.68)  LDD2107  [9]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C32(0.88)  LDD2108  [9]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C32(1.65)  LDD2109  [9]
 LDCM0517  Nucleophilic fragment 21b MDA-MB-231 C192(0.78); C32(0.76)  LDD2110  [9]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C192(1.01); C32(1.01)  LDD2111  [9]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C192(0.52); C32(0.86)  LDD2114  [9]
 LDCM0522  Nucleophilic fragment 24a MDA-MB-231 C192(0.43); C32(0.97)  LDD2115  [9]
 LDCM0523  Nucleophilic fragment 24b MDA-MB-231 C192(0.64)  LDD2116  [9]
 LDCM0525  Nucleophilic fragment 25b MDA-MB-231 C192(0.77); C32(0.99)  LDD2118  [9]
 LDCM0526  Nucleophilic fragment 26a MDA-MB-231 C192(2.31); C32(1.75)  LDD2119  [9]
 LDCM0527  Nucleophilic fragment 26b MDA-MB-231 C192(0.71); C32(1.09)  LDD2120  [9]
 LDCM0530  Nucleophilic fragment 28a MDA-MB-231 C192(1.01); C32(0.74)  LDD2123  [9]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C192(0.41)  LDD2124  [9]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C192(0.82); C32(0.79)  LDD2125  [9]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C192(0.74)  LDD2126  [9]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C192(0.90); C32(0.55)  LDD2127  [9]
 LDCM0535  Nucleophilic fragment 30b MDA-MB-231 C192(0.68); C32(1.60)  LDD2128  [9]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C32(0.71)  LDD2129  [9]
 LDCM0540  Nucleophilic fragment 35 MDA-MB-231 C192(0.41); C32(0.81)  LDD2133  [9]
 LDCM0541  Nucleophilic fragment 36 MDA-MB-231 C192(0.37); C32(0.84)  LDD2134  [9]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C192(0.82); C32(0.67)  LDD2135  [9]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C192(1.05); C32(1.18)  LDD2136  [9]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C192(0.96); C32(0.83)  LDD2137  [9]
 LDCM0211  Nucleophilic fragment 3b MDA-MB-231 C192(1.45); C32(1.17)  LDD1700  [9]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C192(0.62); C32(0.99)  LDD2140  [9]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C192(0.58); C32(0.79)  LDD2141  [9]
 LDCM0549  Nucleophilic fragment 43 MDA-MB-231 C192(0.88); C32(0.83)  LDD2143  [9]
 LDCM0550  Nucleophilic fragment 5a MDA-MB-231 C192(2.76); C32(5.91)  LDD2144  [9]
 LDCM0551  Nucleophilic fragment 5b MDA-MB-231 C192(6.95); C32(13.95)  LDD2145  [9]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C192(0.76); C32(0.86)  LDD2146  [9]
 LDCM0553  Nucleophilic fragment 6b MDA-MB-231 C192(3.33); C32(1.78)  LDD2147  [9]
 LDCM0554  Nucleophilic fragment 7a MDA-MB-231 C192(0.46); C32(1.11)  LDD2148  [9]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C192(0.67); C32(0.63)  LDD2150  [9]
 LDCM0557  Nucleophilic fragment 8b MDA-MB-231 C192(0.60)  LDD2151  [9]
 LDCM0559  Nucleophilic fragment 9b MDA-MB-231 C192(1.91); C32(2.34)  LDD2153  [9]
 LDCM0627  NUDT7-COV-1 HEK-293T C90(0.92); C32(0.11)  LDD2206  [51]
 LDCM0628  OTUB2-COV-1 HEK-293T C112(0.87); C32(0.07)  LDD2207  [51]
 LDCM0159  P28 BxPC-3 1.59  LDD0409  [11]
 LDCM0131  RA190 MM1.R C32(1.06); C192(1.03)  LDD0304  [52]
 LDCM0019  Staurosporine Hep-G2 N.A.  LDD0083  [40]
 LDCM0021  THZ1 HCT 116 C32(1.05)  LDD2173  [44]
 LDCM0110  W12 Hep-G2 C192(6.77); C32(24.30)  LDD0237  [36]
 LDCM0111  W14 Hep-G2 C192(2.08); C32(21.16)  LDD0238  [36]
 LDCM0112  W16 Hep-G2 C32(0.85); N159(3.97)  LDD0239  [36]
 LDCM0113  W17 Hep-G2 N159(0.59); C192(1.14); C32(14.00)  LDD0240  [36]
 LDCM0002  Ward_cp1 U2OS 4.24  LDD0041  [20]
 LDCM0154  YY4 T cell 5.17  LDD0400  [15]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Other
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Heat shock protein beta-1 (HSPB1) Small heat shock protein (HSP20) family P04792

The Drug(s) Related To This Target

Approved
Click To Hide/Show 4 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Glutathione Small molecular drug DB00143
Vitamin E Small molecular drug DB00163
Alpha-tocopherol Succinate . DB14001
D-alpha-tocopherol Acetate . DB14002
Preclinical
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Piperlongumine Small molecular drug D5R7AE

References

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Mass spectrometry data entry: PXD037665
3 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.
4 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.
5 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
6 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.
7 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.
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Mass spectrometry data entry: PXD028270
9 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
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.
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16 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
17 Covalent Inhibition by a Natural Product-Inspired Latent Electrophile. J Am Chem Soc. 2023 May 24;145(20):11097-11109. doi: 10.1021/jacs.3c00598. Epub 2023 May 15.
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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.
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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 Comparison of Quantitative Mass Spectrometry Platforms for Monitoring Kinase ATP Probe Uptake in Lung Cancer. J Proteome Res. 2018 Jan 5;17(1):63-75. doi: 10.1021/acs.jproteome.7b00329. Epub 2017 Nov 22.
Mass spectrometry data entry: PXD006095 , PXD006096
28 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
29 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
30 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
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Mass spectrometry data entry: PXD022279
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.
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36 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.
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38 Large-scale chemoproteomics expedites ligand discovery and predicts ligand behavior in cells. Science. 2024 Apr 26;384(6694):eadk5864. doi: 10.1126/science.adk5864. Epub 2024 Apr 26.
Mass spectrometry data entry: PXD041587
39 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.
40 Comprehensive identification of staurosporine-binding kinases in the hepatocyte cell line HepG2 using Capture Compound Mass Spectrometry (CCMS). J Proteome Res. 2010 Feb 5;9(2):806-17. doi: 10.1021/pr9007333.
41 Cell-based proteome profiling of potential dasatinib targets by use of affinity-based probes. J Am Chem Soc. 2012 Feb 15;134(6):3001-14. doi: 10.1021/ja208518u. Epub 2012 Feb 1.
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Mass spectrometry data entry: PXD007570
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Mass spectrometry data entry: PXD044402
47 An Activity-Guided Map of Electrophile-Cysteine Interactions in Primary Human T Cells. Cell. 2020 Aug 20;182(4):1009-1026.e29. doi: 10.1016/j.cell.2020.07.001. Epub 2020 Jul 29.
48 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
49 DrugMap: A quantitative pan-cancer analysis of cysteine ligandability. Cell. 2024 May 9;187(10):2536-2556.e30. doi: 10.1016/j.cell.2024.03.027. Epub 2024 Apr 22.
Mass spectrometry data entry: PXD047840
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52 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.