Details of the Target

General Information of Target

Target ID LDTP02911
Target Name Calpain-2 catalytic subunit (CAPN2)
Gene Name CAPN2
Gene ID 824
Synonyms
CANPL2; Calpain-2 catalytic subunit; EC 3.4.22.53; Calcium-activated neutral proteinase 2; CANP 2; Calpain M-type; Calpain large polypeptide L2; Calpain-2 large subunit; Millimolar-calpain; M-calpain
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MAGIAAKLAKDREAAEGLGSHDRAIKYLNQDYEALRNECLEAGTLFQDPSFPAIPSALGF
KELGPYSSKTRGIEWKRPTEICADPQFIIGGATRTDICQGALGDCWLLAAIASLTLNEEI
LARVVPLNQSFQENYAGIFHFQFWQYGEWVEVVVDDRLPTKDGELLFVHSAEGSEFWSAL
LEKAYAKINGCYEALSGGATTEGFEDFTGGIAEWYELKKPPPNLFKIIQKALQKGSLLGC
SIDITSAADSEAITFQKLVKGHAYSVTGAEEVESNGSLQKLIRIRNPWGEVEWTGRWNDN
CPSWNTIDPEERERLTRRHEDGEFWMSFSDFLRHYSRLEICNLTPDTLTSDTYKKWKLTK
MDGNWRRGSTAGGCRNYPNTFWMNPQYLIKLEEEDEDEEDGESGCTFLVGLIQKHRRRQR
KMGEDMHTIGFGIYEVPEELSGQTNIHLSKNFFLTNRARERSDTFINLREVLNRFKLPPG
EYILVPSTFEPNKDGDFCIRVFSEKKADYQAVDDEIEANLEEFDISEDDIDDGFRRLFAQ
LAGEDAEISAFELQTILRRVLAKRQDIKSDGFSIETCKIMVDMLDSDGSGKLGLKEFYIL
WTKIQKYQKIYREIDVDRSGTMNSYEMRKALEEAGFKMPCQLHQVIVARFADDQLIIDFD
NFVRCLVRLETLFKIFKQLDPENTGTIELDLISWLCFSVL
Target Type
Clinical trial
Target Bioclass
Enzyme
Family
Peptidase C2 family
Subcellular location
Cytoplasm
Function
Calcium-regulated non-lysosomal thiol-protease which catalyzes limited proteolysis of substrates involved in cytoskeletal remodeling and signal transduction. Proteolytically cleaves MYOC at 'Arg-226'. Proteolytically cleaves CPEB3 following neuronal stimulation which abolishes CPEB3 translational repressor activity, leading to translation of CPEB3 target mRNAs.
TTD ID
T04902
Uniprot ID
P17655
DrugMap ID
TTG5QB7
Ensemble ID
ENST00000295006.6
HGNC ID
HGNC:1479
ChEMBL ID
CHEMBL2382

Target Site Mutations in Different Cell Lines

Cell line Mutation details Probe for labeling this protein in this cell
AN3CA SNV: p.G430C DBIA    Probe Info 
AU565 SNV: p.S619C DBIA    Probe Info 
BT549 SNV: p.P159A DBIA    Probe Info 
HCC15 SNV: p.T79A DBIA    Probe Info 
HEC1 SNV: p.A263T DBIA    Probe Info 
HEC1B SNV: p.A263T IA-alkyne    Probe Info 
IM95 Deletion: p.G198VfsTer20; p.G235AfsTer25 DBIA    Probe Info 
JVM3 SNV: p.C301F DBIA    Probe Info 
KATOIII SNV: p.R94G DBIA    Probe Info 
MOLM16 SNV: p.R285L DBIA    Probe Info 
NCIH1793 SNV: p.D31Y DBIA    Probe Info 
SUDHL6 SNV: p.F662C DBIA    Probe Info 
VCAP SNV: p.N275K DBIA    Probe Info 

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 30 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		14.46  LDD0402  [1]
P3
 Probe Info  		10.00  LDD0450  [2]
CY-1
 Probe Info  		100.00  LDD0243  [3]
CY4
 Probe Info  		100.00  LDD0244  [3]
N1
 Probe Info  		100.00  LDD0242  [3]
STPyne
 Probe Info  		K219(5.16); K360(4.83); K629(4.03); K69(0.20)  LDD0277  [4]
ONAyne
 Probe Info  		K629(9.09)  LDD0275  [4]
BTD
 Probe Info  		C640(2.36); C82(2.26); C374(1.88)  LDD1700  [5]
AHL-Pu-1
 Probe Info  		C374(2.25)  LDD0168  [6]
EA-probe
 Probe Info  		C640(1.05)  LDD2210  [7]
HHS-475
 Probe Info  		Y66(1.22)  LDD0264  [8]
DBIA
 Probe Info  		C640(1.05); C301(1.00); C374(0.86)  LDD0078  [9]
ATP probe
 Probe Info  		K230(0.00); K7(0.00); K226(0.00)  LDD0199  [10]
IA-alkyne
 Probe Info  		C82(0.00); C405(0.00); C341(0.00)  LDD0032  [11]
ATP probe
 Probe Info  		N.A.  LDD0035  [12]
NAIA_4
 Probe Info  		C39(0.00); C82(0.00); C301(0.00); C341(0.00)  LDD2226  [13]
WYneN
 Probe Info  		C374(0.00); C640(0.00)  LDD0021  [14]
WYneO
 Probe Info  		N.A.  LDD0022  [14]
aHNE
 Probe Info  		N.A.  LDD0001  [14]
IPM
 Probe Info  		N.A.  LDD0005  [14]
PF-06672131
 Probe Info  		N.A.  LDD0017  [15]
TFBX
 Probe Info  		C374(0.00); C341(0.00); C577(0.00)  LDD0148  [16]
Phosphinate-6
 Probe Info  		N.A.  LDD0018  [17]
1c-yne
 Probe Info  		N.A.  LDD0228  [18]
Acrolein
 Probe Info  		C301(0.00); C341(0.00); C82(0.00); C640(0.00)  LDD0217  [19]
Crotonaldehyde
 Probe Info  		N.A.  LDD0219  [19]
Methacrolein
 Probe Info  		C301(0.00); C640(0.00); C82(0.00); C577(0.00)  LDD0218  [19]
W1
 Probe Info  		N.A.  LDD0236  [20]
NAIA_5
 Probe Info  		N.A.  LDD2223  [13]
HHS-465
 Probe Info  		N.A.  LDD2240  [21]
PAL-AfBPP Probe
Click To Hide/Show 8 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
C282
 Probe Info  		49.18  LDD1952  [22]
FFF probe11
 Probe Info  		20.00  LDD0471  [23]
FFF probe12
 Probe Info  		12.03  LDD0473  [23]
FFF probe14
 Probe Info  		20.00  LDD0477  [23]
FFF probe3
 Probe Info  		10.24  LDD0464  [23]
FFF probe9
 Probe Info  		20.00  LDD0470  [23]
JN0003
 Probe Info  		20.00  LDD0469  [23]
DA-2
 Probe Info  		N.A.  LDD0071  [24]

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 C640(1.02); C82(0.95)  LDD2142  [5]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C640(0.80); C82(0.61); C301(0.84)  LDD2112  [5]
 LDCM0502  1-(Cyanoacetyl)piperidine MDA-MB-231 C341(0.60); C640(0.58); C374(0.50)  LDD2095  [5]
 LDCM0537  2-Cyano-N,N-dimethylacetamide MDA-MB-231 C640(0.99); C82(0.94)  LDD2130  [5]
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C640(1.04); C82(1.26); C577(1.84); C301(0.96)  LDD2117  [5]
 LDCM0558  2-Cyano-N-phenylacetamide MDA-MB-231 C640(1.29); C374(1.39)  LDD2152  [5]
 LDCM0510  3-(4-(Hydroxydiphenylmethyl)piperidin-1-yl)-3-oxopropanenitrile MDA-MB-231 C640(1.08); C82(1.07)  LDD2103  [5]
 LDCM0539  3-(4-Isopropylpiperazin-1-yl)-3-oxopropanenitrile MDA-MB-231 C341(0.80); C640(0.69); C374(0.40); C82(0.56)  LDD2132  [5]
 LDCM0538  4-(Cyanoacetyl)morpholine MDA-MB-231 C640(0.77); C374(0.71)  LDD2131  [5]
 LDCM0025  4SU-RNA HEK-293T C374(2.25)  LDD0168  [6]
 LDCM0026  4SU-RNA+native RNA HEK-293T C374(20.00)  LDD0169  [6]
 LDCM0214  AC1 HCT 116 C301(1.05); C341(0.83); C498(0.79); C577(0.96)  LDD0531  [9]
 LDCM0215  AC10 HCT 116 C301(1.23); C341(0.76); C498(0.91); C577(1.02)  LDD0532  [9]
 LDCM0216  AC100 HCT 116 C301(1.04); C341(0.72); C498(0.98); C577(1.11)  LDD0533  [9]
 LDCM0217  AC101 HCT 116 C301(1.05); C341(0.85); C498(0.71); C577(0.80)  LDD0534  [9]
 LDCM0218  AC102 HCT 116 C301(1.11); C341(0.84); C498(0.66); C577(0.81)  LDD0535  [9]
 LDCM0219  AC103 HCT 116 C301(1.07); C341(0.64); C498(0.71); C577(0.73)  LDD0536  [9]
 LDCM0220  AC104 HCT 116 C301(0.96); C341(0.70); C498(0.79); C577(0.65)  LDD0537  [9]
 LDCM0221  AC105 HCT 116 C301(1.04); C341(0.76); C498(0.75); C577(0.73)  LDD0538  [9]
 LDCM0222  AC106 HCT 116 C301(1.19); C341(0.59); C498(0.83); C577(0.94)  LDD0539  [9]
 LDCM0223  AC107 HCT 116 C301(1.23); C341(0.67); C498(0.76); C577(0.77)  LDD0540  [9]
 LDCM0224  AC108 HCT 116 C301(0.95); C341(0.70); C498(0.80); C577(0.72)  LDD0541  [9]
 LDCM0225  AC109 HCT 116 C301(1.05); C341(0.86); C498(0.74); C577(1.05)  LDD0542  [9]
 LDCM0226  AC11 HCT 116 C301(1.07); C341(0.89); C498(0.74); C577(0.91)  LDD0543  [9]
 LDCM0227  AC110 HCT 116 C301(1.09); C341(0.73); C498(0.71); C577(0.97)  LDD0544  [9]
 LDCM0228  AC111 HCT 116 C301(0.99); C341(0.72); C498(0.65); C577(0.70)  LDD0545  [9]
 LDCM0229  AC112 HCT 116 C301(1.12); C341(0.65); C498(0.67); C577(0.80)  LDD0546  [9]
 LDCM0230  AC113 HCT 116 C301(0.97); C341(1.14); C498(0.95); C577(1.02)  LDD0547  [9]
 LDCM0231  AC114 HCT 116 C301(1.17); C341(0.87); C498(0.86); C577(0.92)  LDD0548  [9]
 LDCM0232  AC115 HCT 116 C301(1.11); C341(0.83); C498(0.96); C577(0.96)  LDD0549  [9]
 LDCM0233  AC116 HCT 116 C301(1.02); C341(0.80); C498(0.84); C577(0.88)  LDD0550  [9]
 LDCM0234  AC117 HCT 116 C301(1.05); C341(0.85); C498(0.97); C577(0.86)  LDD0551  [9]
 LDCM0235  AC118 HCT 116 C301(1.03); C341(0.95); C498(0.99); C577(1.03)  LDD0552  [9]
 LDCM0236  AC119 HCT 116 C301(0.99); C341(0.90); C498(0.94); C577(1.02)  LDD0553  [9]
 LDCM0237  AC12 HCT 116 C301(1.06); C341(1.05); C498(0.94); C577(0.99)  LDD0554  [9]
 LDCM0238  AC120 HCT 116 C301(1.13); C341(0.85); C498(0.78); C577(0.87)  LDD0555  [9]
 LDCM0239  AC121 HCT 116 C301(1.05); C341(1.20); C498(1.15); C577(1.05)  LDD0556  [9]
 LDCM0240  AC122 HCT 116 C301(1.05); C341(1.01); C498(0.92); C577(0.90)  LDD0557  [9]
 LDCM0241  AC123 HCT 116 C301(1.01); C341(0.88); C498(0.93); C577(1.05)  LDD0558  [9]
 LDCM0242  AC124 HCT 116 C301(1.11); C341(1.10); C498(1.05); C577(1.02)  LDD0559  [9]
 LDCM0243  AC125 HCT 116 C301(1.14); C341(1.00); C498(0.96); C577(1.03)  LDD0560  [9]
 LDCM0244  AC126 HCT 116 C301(1.08); C341(0.88); C498(0.78); C577(0.99)  LDD0561  [9]
 LDCM0245  AC127 HCT 116 C301(0.95); C341(0.86); C498(0.84); C577(1.01)  LDD0562  [9]
 LDCM0246  AC128 HCT 116 C301(0.90); C341(1.21); C498(1.24); C577(1.33)  LDD0563  [9]
 LDCM0247  AC129 HCT 116 C301(0.94); C341(1.08); C498(1.06); C577(1.28)  LDD0564  [9]
 LDCM0249  AC130 HCT 116 C301(0.98); C341(0.88); C498(0.95); C577(1.14)  LDD0566  [9]
 LDCM0250  AC131 HCT 116 C301(1.05); C341(1.07); C498(0.93); C577(1.24)  LDD0567  [9]
 LDCM0251  AC132 HCT 116 C301(1.11); C341(0.86); C498(1.10); C577(1.32)  LDD0568  [9]
 LDCM0252  AC133 HCT 116 C301(1.04); C341(0.87); C498(1.02); C577(1.03)  LDD0569  [9]
 LDCM0253  AC134 HCT 116 C301(1.11); C341(1.07); C498(0.97); C577(1.08)  LDD0570  [9]
 LDCM0254  AC135 HCT 116 C301(1.07); C341(1.04); C498(1.08); C577(1.26)  LDD0571  [9]
 LDCM0255  AC136 HCT 116 C301(1.11); C341(0.96); C498(1.04); C577(1.08)  LDD0572  [9]
 LDCM0256  AC137 HCT 116 C301(1.21); C341(0.99); C498(0.89); C577(1.07)  LDD0573  [9]
 LDCM0257  AC138 HCT 116 C301(1.60); C341(1.34); C498(0.96); C577(0.99)  LDD0574  [9]
 LDCM0258  AC139 HCT 116 C301(1.26); C341(0.91); C498(0.90); C577(1.09)  LDD0575  [9]
 LDCM0259  AC14 HCT 116 C301(1.10); C341(0.74); C498(0.68); C577(0.95)  LDD0576  [9]
 LDCM0260  AC140 HCT 116 C301(1.39); C341(1.07); C498(1.03); C577(1.06)  LDD0577  [9]
 LDCM0261  AC141 HCT 116 C301(1.42); C341(1.08); C498(0.95); C577(1.07)  LDD0578  [9]
 LDCM0262  AC142 HCT 116 C301(1.17); C341(0.90); C498(1.07); C577(1.05)  LDD0579  [9]
 LDCM0263  AC143 HCT 116 C191(0.84); C301(1.03); C341(0.82); C498(0.92)  LDD0580  [9]
 LDCM0264  AC144 HCT 116 C191(0.68); C341(0.71); C640(0.76); C577(0.84)  LDD0581  [9]
 LDCM0265  AC145 HCT 116 C341(0.82); C577(0.87); C191(0.94); C498(1.01)  LDD0582  [9]
 LDCM0266  AC146 HCT 116 C191(0.54); C341(0.63); C640(0.72); C498(0.78)  LDD0583  [9]
 LDCM0267  AC147 HCT 116 C191(0.62); C341(0.80); C498(0.90); C640(0.91)  LDD0584  [9]
 LDCM0268  AC148 HCT 116 C191(0.57); C341(0.60); C640(0.74); C577(0.83)  LDD0585  [9]
 LDCM0269  AC149 HCT 116 C191(0.48); C341(0.62); C640(0.64); C498(0.73)  LDD0586  [9]
 LDCM0270  AC15 HCT 116 C498(0.82); C82(0.83); C341(0.84); C577(0.94)  LDD0587  [9]
 LDCM0271  AC150 HCT 116 C577(0.74); C191(0.84); C341(0.85); C498(0.85)  LDD0588  [9]
 LDCM0272  AC151 HCT 116 C341(0.82); C191(0.84); C498(0.88); C640(0.90)  LDD0589  [9]
 LDCM0273  AC152 HCT 116 C191(0.52); C341(0.64); C577(0.66); C498(0.72)  LDD0590  [9]
 LDCM0274  AC153 HCT 116 C341(0.51); C191(0.55); C577(0.58); C640(0.70)  LDD0591  [9]
 LDCM0621  AC154 HCT 116 C191(0.73); C301(0.99); C341(0.77); C498(0.90)  LDD2158  [9]
 LDCM0622  AC155 HCT 116 C191(0.70); C301(1.14); C341(0.67); C498(0.88)  LDD2159  [9]
 LDCM0623  AC156 HCT 116 C191(1.23); C301(1.13); C341(0.83); C498(0.88)  LDD2160  [9]
 LDCM0624  AC157 HCT 116 C191(0.87); C301(1.05); C341(0.85); C498(0.95)  LDD2161  [9]
 LDCM0276  AC17 HCT 116 C240(0.73); C301(0.79); C577(0.90); C82(0.94)  LDD0593  [9]
 LDCM0277  AC18 HCT 116 C240(0.35); C577(0.91); C82(0.96); C640(1.00)  LDD0594  [9]
 LDCM0278  AC19 HCT 116 C240(0.56); C577(0.94); C301(0.97); C82(0.98)  LDD0595  [9]
 LDCM0279  AC2 HCT 116 C341(0.92); C640(0.94); C498(0.95); C301(0.99)  LDD0596  [9]
 LDCM0280  AC20 HCT 116 C240(0.85); C82(0.92); C341(0.99); C640(1.00)  LDD0597  [9]
 LDCM0281  AC21 HCT 116 C240(0.62); C82(0.86); C341(0.94); C577(0.95)  LDD0598  [9]
 LDCM0282  AC22 HCT 116 C240(0.79); C82(0.89); C301(0.99); C577(1.00)  LDD0599  [9]
 LDCM0283  AC23 HCT 116 C240(0.61); C82(0.92); C640(0.97); C577(0.97)  LDD0600  [9]
 LDCM0284  AC24 HCT 116 C240(0.89); C301(0.91); C82(0.92); C341(1.04)  LDD0601  [9]
 LDCM0285  AC25 HCT 116 C82(0.86); C301(0.86); C640(0.98); C341(0.99)  LDD0602  [9]
 LDCM0286  AC26 HCT 116 C82(0.85); C640(0.92); C498(0.97); C577(1.02)  LDD0603  [9]
 LDCM0287  AC27 HCT 116 C82(0.88); C498(0.90); C640(0.93); C341(1.00)  LDD0604  [9]
 LDCM0288  AC28 HCT 116 C82(0.90); C498(0.92); C640(0.93); C301(0.96)  LDD0605  [9]
 LDCM0289  AC29 HCT 116 C498(0.85); C82(0.86); C640(0.88); C577(0.91)  LDD0606  [9]
 LDCM0290  AC3 HCT 116 C82(0.87); C341(0.92); C498(0.94); C301(0.95)  LDD0607  [9]
 LDCM0291  AC30 HCT 116 C341(0.77); C498(0.78); C640(0.78); C82(0.80)  LDD0608  [9]
 LDCM0292  AC31 HCT 116 C640(0.82); C82(0.91); C577(0.91); C498(0.97)  LDD0609  [9]
 LDCM0293  AC32 HCT 116 C82(0.80); C498(0.84); C640(0.86); C577(0.90)  LDD0610  [9]
 LDCM0294  AC33 HCT 116 C82(0.76); C498(0.81); C640(0.83); C577(0.99)  LDD0611  [9]
 LDCM0295  AC34 HCT 116 C82(0.73); C498(0.77); C577(0.87); C640(0.90)  LDD0612  [9]
 LDCM0296  AC35 HCT 116 C301(1.09); C82(1.09); C577(1.10); C640(1.10)  LDD0613  [9]
 LDCM0297  AC36 HCT 116 C498(0.90); C640(0.95); C577(0.95); C301(1.05)  LDD0614  [9]
 LDCM0298  AC37 HCT 116 C341(0.93); C498(0.96); C577(0.97); C640(0.99)  LDD0615  [9]
 LDCM0299  AC38 HCT 116 C498(0.79); C577(0.91); C640(0.95); C82(1.02)  LDD0616  [9]
 LDCM0300  AC39 HCT 116 C577(0.99); C82(1.03); C240(1.06); C640(1.08)  LDD0617  [9]
 LDCM0301  AC4 HCT 116 C82(0.81); C640(0.89); C498(0.92); C301(0.98)  LDD0618  [9]
 LDCM0302  AC40 HCT 116 C240(0.81); C577(0.84); C498(0.87); C640(0.97)  LDD0619  [9]
 LDCM0303  AC41 HCT 116 C498(0.85); C341(0.91); C577(0.96); C82(1.03)  LDD0620  [9]
 LDCM0304  AC42 HCT 116 C498(0.84); C577(0.90); C341(0.97); C82(0.97)  LDD0621  [9]
 LDCM0305  AC43 HCT 116 C577(0.79); C498(0.81); C341(0.83); C240(0.84)  LDD0622  [9]
 LDCM0306  AC44 HCT 116 C498(0.88); C577(0.99); C341(1.06); C301(1.06)  LDD0623  [9]
 LDCM0307  AC45 HCT 116 C240(0.79); C577(0.85); C498(0.87); C341(0.94)  LDD0624  [9]
 LDCM0308  AC46 HCT 116 C191(0.75); C577(0.84); C341(0.89); C240(0.90)  LDD0625  [9]
 LDCM0309  AC47 HCT 116 C577(0.81); C82(0.91); C240(0.95); C341(0.96)  LDD0626  [9]
 LDCM0310  AC48 HCT 116 C240(0.53); C191(0.55); C577(0.72); C82(0.75)  LDD0627  [9]
 LDCM0311  AC49 HCT 116 C240(0.68); C577(0.77); C341(0.80); C498(0.85)  LDD0628  [9]
 LDCM0312  AC5 HCT 116 C640(0.92); C82(0.93); C498(0.97); C301(1.00)  LDD0629  [9]
 LDCM0313  AC50 HCT 116 C240(0.67); C577(0.77); C341(0.77); C82(0.86)  LDD0630  [9]
 LDCM0314  AC51 HCT 116 C640(1.04); C341(1.05); C191(1.08); C82(1.10)  LDD0631  [9]
 LDCM0315  AC52 HCT 116 C577(0.91); C240(0.92); C191(0.94); C341(0.96)  LDD0632  [9]
 LDCM0316  AC53 HCT 116 C240(0.63); C577(0.81); C191(0.82); C82(0.83)  LDD0633  [9]
 LDCM0317  AC54 HCT 116 C240(0.77); C577(0.80); C341(0.93); C498(0.96)  LDD0634  [9]
 LDCM0318  AC55 HCT 116 C240(0.58); C191(0.63); C82(0.76); C341(0.78)  LDD0635  [9]
 LDCM0319  AC56 HCT 116 C240(0.39); C191(0.51); C577(0.61); C341(0.64)  LDD0636  [9]
 LDCM0320  AC57 HCT 116 C240(0.41); C191(0.62); C341(0.74); C577(0.91)  LDD0637  [9]
 LDCM0321  AC58 HCT 116 C240(0.29); C191(0.60); C341(0.75); C577(0.87)  LDD0638  [9]
 LDCM0322  AC59 HCT 116 C240(0.44); C191(0.66); C341(0.82); C577(0.95)  LDD0639  [9]
 LDCM0323  AC6 HCT 116 C498(0.75); C82(0.81); C341(0.86); C640(0.97)  LDD0640  [9]
 LDCM0324  AC60 HCT 116 C240(0.38); C191(0.43); C341(0.68); C577(0.79)  LDD0641  [9]
 LDCM0325  AC61 HCT 116 C240(0.34); C191(0.43); C577(0.77); C341(0.77)  LDD0642  [9]
 LDCM0326  AC62 HCT 116 C191(0.42); C240(0.42); C341(0.71); C577(0.90)  LDD0643  [9]
 LDCM0327  AC63 HCT 116 C240(0.31); C191(0.38); C341(0.66); C577(0.78)  LDD0644  [9]
 LDCM0328  AC64 HCT 116 C240(0.39); C191(0.55); C341(0.78); C577(0.88)  LDD0645  [9]
 LDCM0329  AC65 HCT 116 C240(0.51); C191(0.65); C341(0.81); C577(0.91)  LDD0646  [9]
 LDCM0330  AC66 HCT 116 C240(0.47); C191(0.60); C341(0.84); C577(0.97)  LDD0647  [9]
 LDCM0331  AC67 HCT 116 C240(0.27); C191(0.40); C341(0.67); C577(0.72)  LDD0648  [9]
 LDCM0332  AC68 HCT 116 C301(0.70); C341(0.78); C640(0.83); C498(0.91)  LDD0649  [9]
 LDCM0333  AC69 HCT 116 C301(0.64); C341(0.70); C577(0.82); C640(0.84)  LDD0650  [9]
 LDCM0334  AC7 HCT 116 C498(0.81); C341(0.85); C82(0.90); C640(0.96)  LDD0651  [9]
 LDCM0335  AC70 HCT 116 C341(0.71); C577(0.77); C301(0.82); C640(0.93)  LDD0652  [9]
 LDCM0336  AC71 HCT 116 C301(0.78); C341(0.95); C640(0.96); C577(1.09)  LDD0653  [9]
 LDCM0337  AC72 HCT 116 C301(0.67); C341(0.87); C498(0.98); C640(0.98)  LDD0654  [9]
 LDCM0338  AC73 HCT 116 C301(0.75); C341(0.75); C577(0.84); C640(0.88)  LDD0655  [9]
 LDCM0339  AC74 HCT 116 C341(0.67); C301(0.75); C577(0.80); C640(0.83)  LDD0656  [9]
 LDCM0340  AC75 HCT 116 C341(0.62); C640(0.79); C301(0.79); C577(0.82)  LDD0657  [9]
 LDCM0341  AC76 HCT 116 C301(0.79); C341(0.99); C640(1.02); C577(1.03)  LDD0658  [9]
 LDCM0342  AC77 HCT 116 C341(0.85); C301(0.87); C640(0.92); C498(0.92)  LDD0659  [9]
 LDCM0343  AC78 HCT 116 C341(0.69); C640(0.79); C577(0.80); C301(0.84)  LDD0660  [9]
 LDCM0344  AC79 HCT 116 C301(0.77); C498(0.94); C341(1.05); C640(1.10)  LDD0661  [9]
 LDCM0345  AC8 HCT 116 C498(0.83); C341(0.83); C577(0.90); C82(0.91)  LDD0662  [9]
 LDCM0346  AC80 HCT 116 C301(0.81); C341(0.90); C640(0.96); C577(1.00)  LDD0663  [9]
 LDCM0347  AC81 HCT 116 C301(0.77); C640(0.87); C341(0.90); C577(0.93)  LDD0664  [9]
 LDCM0348  AC82 HCT 116 C341(0.63); C577(0.77); C640(0.78); C301(0.96)  LDD0665  [9]
 LDCM0349  AC83 HCT 116 C577(0.65); C498(0.72); C640(0.78); C82(0.84)  LDD0666  [9]
 LDCM0350  AC84 HCT 116 C577(0.65); C498(0.73); C640(0.79); C82(0.83)  LDD0667  [9]
 LDCM0351  AC85 HCT 116 C577(0.69); C640(0.77); C498(0.79); C82(0.79)  LDD0668  [9]
 LDCM0352  AC86 HCT 116 C498(0.91); C577(0.93); C640(0.97); C82(1.00)  LDD0669  [9]
 LDCM0353  AC87 HCT 116 C640(0.84); C577(0.88); C82(0.90); C341(0.92)  LDD0670  [9]
 LDCM0354  AC88 HCT 116 C640(0.91); C341(0.94); C577(0.94); C82(0.97)  LDD0671  [9]
 LDCM0355  AC89 HCT 116 C640(0.77); C577(0.79); C82(0.87); C498(0.88)  LDD0672  [9]
 LDCM0357  AC90 HCT 116 C82(1.02); C640(1.06); C341(1.17); C577(1.23)  LDD0674  [9]
 LDCM0358  AC91 HCT 116 C577(0.85); C498(0.89); C82(0.89); C640(0.90)  LDD0675  [9]
 LDCM0359  AC92 HCT 116 C577(0.85); C82(0.87); C498(0.89); C640(0.91)  LDD0676  [9]
 LDCM0360  AC93 HCT 116 C577(0.79); C640(0.85); C498(0.86); C341(0.89)  LDD0677  [9]
 LDCM0361  AC94 HCT 116 C498(0.86); C640(0.88); C577(0.92); C341(0.96)  LDD0678  [9]
 LDCM0362  AC95 HCT 116 C577(0.69); C640(0.71); C498(0.77); C341(0.78)  LDD0679  [9]
 LDCM0363  AC96 HCT 116 C577(0.80); C640(0.83); C341(0.85); C82(0.89)  LDD0680  [9]
 LDCM0364  AC97 HCT 116 C498(0.81); C577(0.84); C640(0.85); C341(0.92)  LDD0681  [9]
 LDCM0365  AC98 HCT 116 C341(0.49); C640(0.50); C498(0.56); C577(0.68)  LDD0682  [9]
 LDCM0366  AC99 HCT 116 C341(0.74); C577(0.78); C498(0.80); C640(0.88)  LDD0683  [9]
 LDCM0545  Acetamide MDA-MB-231 C640(0.50); C374(0.38); C82(0.56)  LDD2138  [5]
 LDCM0520  AKOS000195272 MDA-MB-231 C374(0.93); C82(0.67)  LDD2113  [5]
 LDCM0248  AKOS034007472 HCT 116 C301(1.07); C341(0.91); C498(0.95); C577(1.10)  LDD0565  [9]
 LDCM0356  AKOS034007680 HCT 116 C341(0.81); C498(0.84); C82(0.92); C640(0.93)  LDD0673  [9]
 LDCM0275  AKOS034007705 HCT 116 C82(0.69); C498(0.73); C341(0.74); C640(0.98)  LDD0592  [9]
 LDCM0156  Aniline NCI-H1299 11.34  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C640(1.05); C301(1.00); C374(0.86)  LDD0078  [9]
 LDCM0498  BS-3668 MDA-MB-231 C341(0.71); C640(0.59); C374(0.44); C82(0.68)  LDD2091  [5]
 LDCM0630  CCW28-3 231MFP C82(1.64); C98(1.60); C105(1.46); C301(1.35)  LDD2214  [25]
 LDCM0108  Chloroacetamide HeLa C341(0.00); C82(0.00); C301(0.00); C577(0.00)  LDD0222  [19]
 LDCM0367  CL1 HCT 116 C82(0.89); C341(0.93); C640(0.98); C498(1.03)  LDD0684  [9]
 LDCM0368  CL10 HCT 116 C191(0.48); C82(0.53); C341(0.66); C640(0.72)  LDD0685  [9]
 LDCM0369  CL100 HCT 116 C82(0.78); C640(0.87); C498(0.91); C341(0.92)  LDD0686  [9]
 LDCM0370  CL101 HCT 116 C498(0.77); C82(0.81); C341(0.82); C640(0.92)  LDD0687  [9]
 LDCM0371  CL102 HCT 116 C82(0.87); C301(0.87); C341(0.93); C498(0.96)  LDD0688  [9]
 LDCM0372  CL103 HCT 116 C82(0.87); C640(0.91); C301(0.93); C498(0.99)  LDD0689  [9]
 LDCM0373  CL104 HCT 116 C82(0.80); C341(0.86); C498(0.89); C640(0.94)  LDD0690  [9]
 LDCM0374  CL105 HCT 116 C240(0.45); C577(0.82); C82(0.93); C341(0.95)  LDD0691  [9]
 LDCM0375  CL106 HCT 116 C240(0.20); C577(0.79); C640(0.80); C82(0.92)  LDD0692  [9]
 LDCM0376  CL107 HCT 116 C240(0.31); C577(0.84); C341(0.95); C82(0.95)  LDD0693  [9]
 LDCM0377  CL108 HCT 116 C240(0.32); C577(0.81); C82(0.87); C498(0.92)  LDD0694  [9]
 LDCM0378  CL109 HCT 116 C240(0.48); C577(0.85); C82(0.86); C341(0.91)  LDD0695  [9]
 LDCM0379  CL11 HCT 116 C82(0.50); C191(0.52); C341(0.68); C640(0.74)  LDD0696  [9]
 LDCM0380  CL110 HCT 116 C240(0.32); C82(0.79); C577(0.79); C341(0.90)  LDD0697  [9]
 LDCM0381  CL111 HCT 116 C240(0.44); C577(0.83); C82(0.83); C341(0.89)  LDD0698  [9]
 LDCM0382  CL112 HCT 116 C301(0.84); C82(0.93); C640(0.99); C341(1.00)  LDD0699  [9]
 LDCM0383  CL113 HCT 116 C82(0.78); C498(0.79); C577(0.83); C640(0.90)  LDD0700  [9]
 LDCM0384  CL114 HCT 116 C341(0.76); C82(0.77); C640(0.86); C498(0.88)  LDD0701  [9]
 LDCM0385  CL115 HCT 116 C498(0.76); C341(0.80); C577(0.81); C82(0.81)  LDD0702  [9]
 LDCM0386  CL116 HCT 116 C498(0.81); C577(0.84); C82(0.84); C640(0.87)  LDD0703  [9]
 LDCM0387  CL117 HCT 116 C240(0.66); C577(0.80); C640(0.86); C82(0.90)  LDD0704  [9]
 LDCM0388  CL118 HCT 116 C498(0.84); C577(0.93); C82(0.96); C640(1.03)  LDD0705  [9]
 LDCM0389  CL119 HCT 116 C498(0.88); C240(0.90); C341(1.00); C577(1.01)  LDD0706  [9]
 LDCM0390  CL12 HCT 116 C191(0.56); C82(0.83); C577(0.86); C341(0.86)  LDD0707  [9]
 LDCM0391  CL120 HCT 116 C498(0.88); C577(0.90); C82(1.01); C341(1.05)  LDD0708  [9]
 LDCM0392  CL121 HCT 116 C640(0.75); C341(0.83); C498(0.99); C191(1.11)  LDD0709  [9]
 LDCM0393  CL122 HCT 116 C240(0.57); C577(0.65); C191(0.68); C341(0.72)  LDD0710  [9]
 LDCM0394  CL123 HCT 116 C240(0.57); C82(0.85); C191(0.86); C498(0.86)  LDD0711  [9]
 LDCM0395  CL124 HCT 116 C240(0.61); C577(0.76); C191(0.82); C341(0.83)  LDD0712  [9]
 LDCM0396  CL125 HCT 116 C301(0.88); C341(0.96); C498(0.99); C240(1.02)  LDD0713  [9]
 LDCM0397  CL126 HCT 116 C191(0.78); C341(0.82); C498(0.88); C577(0.94)  LDD0714  [9]
 LDCM0398  CL127 HCT 116 C191(0.59); C240(0.81); C341(0.86); C498(1.00)  LDD0715  [9]
 LDCM0399  CL128 HCT 116 C240(0.56); C191(0.76); C341(0.88); C301(1.01)  LDD0716  [9]
 LDCM0400  CL13 HCT 116 C191(0.44); C82(0.67); C577(0.67); C640(0.72)  LDD0717  [9]
 LDCM0401  CL14 HCT 116 C82(0.60); C191(0.79); C498(0.81); C577(0.83)  LDD0718  [9]
 LDCM0402  CL15 HCT 116 C191(0.43); C82(0.48); C577(0.64); C640(0.76)  LDD0719  [9]
 LDCM0403  CL16 HCT 116 C191(0.82); C341(0.83); C577(0.89); C301(0.90)  LDD0720  [9]
 LDCM0404  CL17 HCT 116 C191(0.48); C240(0.53); C577(0.79); C640(0.82)  LDD0721  [9]
 LDCM0405  CL18 HCT 116 C191(0.25); C240(0.30); C577(0.59); C82(0.61)  LDD0722  [9]
 LDCM0406  CL19 HCT 116 C191(0.34); C240(0.52); C577(0.68); C498(0.81)  LDD0723  [9]
 LDCM0407  CL2 HCT 116 C191(0.74); C82(0.83); C640(0.92); C577(1.00)  LDD0724  [9]
 LDCM0408  CL20 HCT 116 C240(0.51); C191(0.58); C82(0.79); C640(0.88)  LDD0725  [9]
 LDCM0409  CL21 HCT 116 C240(0.32); C191(0.35); C82(0.71); C640(0.77)  LDD0726  [9]
 LDCM0410  CL22 HCT 116 C240(0.31); C191(0.38); C640(0.73); C577(0.79)  LDD0727  [9]
 LDCM0411  CL23 HCT 116 C240(0.57); C191(0.61); C82(0.81); C341(0.87)  LDD0728  [9]
 LDCM0412  CL24 HCT 116 C240(0.46); C191(0.47); C577(0.82); C82(0.85)  LDD0729  [9]
 LDCM0413  CL25 HCT 116 C191(0.52); C240(0.39); C301(1.07); C341(0.77)  LDD0730  [9]
 LDCM0414  CL26 HCT 116 C191(0.48); C240(0.49); C301(1.11); C341(0.78)  LDD0731  [9]
 LDCM0415  CL27 HCT 116 C191(0.63); C240(0.52); C301(0.85); C341(0.96)  LDD0732  [9]
 LDCM0416  CL28 HCT 116 C191(0.43); C240(0.41); C301(0.93); C341(0.91)  LDD0733  [9]
 LDCM0417  CL29 HCT 116 C191(0.46); C240(0.43); C301(0.93); C341(1.07)  LDD0734  [9]
 LDCM0418  CL3 HCT 116 C191(0.76); C301(1.05); C341(0.93); C498(1.33)  LDD0735  [9]
 LDCM0419  CL30 HCT 116 C191(0.66); C240(0.58); C301(1.05); C341(0.95)  LDD0736  [9]
 LDCM0420  CL31 HCT 116 C301(0.93); C341(0.89); C498(1.03); C577(0.95)  LDD0737  [9]
 LDCM0421  CL32 HCT 116 C301(1.05); C341(0.58); C498(0.54); C577(0.56)  LDD0738  [9]
 LDCM0422  CL33 HCT 116 C301(1.06); C341(0.64); C498(0.72); C577(0.61)  LDD0739  [9]
 LDCM0423  CL34 HCT 116 C301(1.09); C341(0.67); C498(0.66); C577(0.76)  LDD0740  [9]
 LDCM0424  CL35 HCT 116 C301(1.01); C341(0.71); C498(0.89); C577(0.85)  LDD0741  [9]
 LDCM0425  CL36 HCT 116 C301(1.03); C341(0.78); C498(0.97); C577(0.83)  LDD0742  [9]
 LDCM0426  CL37 HCT 116 C301(1.07); C341(0.69); C498(0.91); C577(0.83)  LDD0743  [9]
 LDCM0428  CL39 HCT 116 C301(1.16); C341(0.81); C498(0.94); C577(0.81)  LDD0745  [9]
 LDCM0429  CL4 HCT 116 C191(0.73); C301(0.98); C341(0.84); C498(0.83)  LDD0746  [9]
 LDCM0430  CL40 HCT 116 C301(1.07); C341(0.78); C498(0.74); C577(0.89)  LDD0747  [9]
 LDCM0431  CL41 HCT 116 C301(1.00); C341(0.84); C498(0.85); C577(0.89)  LDD0748  [9]
 LDCM0432  CL42 HCT 116 C301(1.05); C341(0.64); C498(0.74); C577(0.73)  LDD0749  [9]
 LDCM0433  CL43 HCT 116 C301(1.06); C341(0.68); C498(0.67); C577(0.73)  LDD0750  [9]
 LDCM0434  CL44 HCT 116 C301(1.00); C341(0.65); C498(0.69); C577(0.67)  LDD0751  [9]
 LDCM0435  CL45 HCT 116 C301(0.83); C341(0.66); C498(0.74); C577(0.72)  LDD0752  [9]
 LDCM0436  CL46 HCT 116 C301(0.84); C341(1.29); C498(0.76); C577(1.25)  LDD0753  [9]
 LDCM0437  CL47 HCT 116 C301(1.01); C341(1.05); C498(0.88); C577(1.15)  LDD0754  [9]
 LDCM0438  CL48 HCT 116 C301(0.88); C341(1.42); C498(0.90); C577(1.27)  LDD0755  [9]
 LDCM0439  CL49 HCT 116 C301(0.89); C341(1.30); C498(1.04); C577(1.32)  LDD0756  [9]
 LDCM0440  CL5 HCT 116 C191(0.63); C301(0.91); C341(0.94); C498(1.11)  LDD0757  [9]
 LDCM0441  CL50 HCT 116 C301(0.97); C341(1.35); C498(0.98); C577(1.24)  LDD0758  [9]
 LDCM0442  CL51 HCT 116 C301(0.90); C341(1.33); C498(1.01); C577(1.22)  LDD0759  [9]
 LDCM0443  CL52 HCT 116 C301(0.96); C341(1.26); C498(0.98); C577(1.28)  LDD0760  [9]
 LDCM0444  CL53 HCT 116 C301(0.95); C341(1.05); C498(0.76); C577(1.08)  LDD0761  [9]
 LDCM0445  CL54 HCT 116 C301(0.96); C341(1.15); C498(1.01); C577(1.19)  LDD0762  [9]
 LDCM0446  CL55 HCT 116 C301(0.93); C341(1.21); C498(1.10); C577(1.21)  LDD0763  [9]
 LDCM0447  CL56 HCT 116 C301(1.06); C341(1.01); C498(0.92); C577(1.08)  LDD0764  [9]
 LDCM0448  CL57 HCT 116 C301(0.97); C341(1.08); C498(0.91); C577(1.12)  LDD0765  [9]
 LDCM0449  CL58 HCT 116 C301(0.88); C341(1.29); C498(0.91); C577(1.17)  LDD0766  [9]
 LDCM0450  CL59 HCT 116 C301(1.01); C341(1.14); C498(1.12); C577(1.29)  LDD0767  [9]
 LDCM0451  CL6 HCT 116 C191(0.49); C301(1.01); C341(0.83); C498(0.79)  LDD0768  [9]
 LDCM0452  CL60 HCT 116 C301(0.96); C341(1.04); C498(0.95); C577(1.10)  LDD0769  [9]
 LDCM0453  CL61 HCT 116 C191(1.02); C301(1.29); C341(0.93); C498(0.90)  LDD0770  [9]
 LDCM0454  CL62 HCT 116 C191(1.15); C301(0.98); C341(0.87); C498(0.85)  LDD0771  [9]
 LDCM0455  CL63 HCT 116 C191(1.06); C301(0.90); C341(0.89); C498(0.83)  LDD0772  [9]
 LDCM0456  CL64 HCT 116 C191(0.79); C301(1.30); C341(0.79); C498(0.75)  LDD0773  [9]
 LDCM0457  CL65 HCT 116 C191(1.01); C301(1.48); C341(0.90); C498(0.88)  LDD0774  [9]
 LDCM0458  CL66 HCT 116 C191(0.69); C301(1.09); C341(0.84); C498(0.74)  LDD0775  [9]
 LDCM0459  CL67 HCT 116 C191(0.85); C301(1.33); C341(0.86); C498(0.71)  LDD0776  [9]
 LDCM0460  CL68 HCT 116 C191(0.77); C301(1.06); C341(0.69); C498(0.65)  LDD0777  [9]
 LDCM0461  CL69 HCT 116 C191(0.67); C301(1.21); C341(0.60); C498(0.57)  LDD0778  [9]
 LDCM0462  CL7 HCT 116 C191(0.57); C301(0.86); C341(0.94); C498(0.88)  LDD0779  [9]
 LDCM0463  CL70 HCT 116 C191(0.66); C301(1.23); C341(0.69); C498(0.68)  LDD0780  [9]
 LDCM0464  CL71 HCT 116 C191(0.94); C301(1.08); C341(0.82); C498(0.83)  LDD0781  [9]
 LDCM0465  CL72 HCT 116 C191(1.34); C301(1.03); C341(1.07); C498(0.84)  LDD0782  [9]
 LDCM0466  CL73 HCT 116 C191(0.93); C301(1.10); C341(0.82); C498(0.78)  LDD0783  [9]
 LDCM0467  CL74 HCT 116 C191(0.94); C301(1.17); C341(0.88); C498(0.78)  LDD0784  [9]
 LDCM0469  CL76 HCT 116 C191(0.58); C301(0.95); C341(0.81); C498(0.77)  LDD0786  [9]
 LDCM0470  CL77 HCT 116 C191(1.51); C301(1.03); C341(1.07); C498(0.84)  LDD0787  [9]
 LDCM0471  CL78 HCT 116 C191(0.83); C301(1.20); C341(0.95); C498(1.11)  LDD0788  [9]
 LDCM0472  CL79 HCT 116 C191(0.80); C301(0.97); C341(0.81); C498(0.96)  LDD0789  [9]
 LDCM0473  CL8 HCT 116 C191(0.47); C301(0.92); C341(0.83); C498(0.86)  LDD0790  [9]
 LDCM0474  CL80 HCT 116 C191(0.59); C301(1.28); C341(0.65); C498(0.78)  LDD0791  [9]
 LDCM0475  CL81 HCT 116 C191(1.10); C301(0.90); C341(1.09); C498(1.01)  LDD0792  [9]
 LDCM0476  CL82 HCT 116 C191(0.64); C301(1.18); C341(0.99); C498(0.90)  LDD0793  [9]
 LDCM0477  CL83 HCT 116 C191(0.66); C301(1.56); C341(0.75); C498(0.90)  LDD0794  [9]
 LDCM0478  CL84 HCT 116 C191(0.54); C301(1.16); C341(0.66); C498(0.78)  LDD0795  [9]
 LDCM0479  CL85 HCT 116 C191(0.74); C301(1.01); C341(0.97); C498(0.81)  LDD0796  [9]
 LDCM0480  CL86 HCT 116 C191(1.08); C301(1.23); C341(1.20); C498(0.92)  LDD0797  [9]
 LDCM0481  CL87 HCT 116 C191(1.06); C301(0.92); C341(1.04); C498(0.97)  LDD0798  [9]
 LDCM0482  CL88 HCT 116 C191(0.72); C301(0.92); C341(0.85); C498(0.83)  LDD0799  [9]
 LDCM0483  CL89 HCT 116 C191(0.58); C301(1.52); C341(0.71); C498(0.80)  LDD0800  [9]
 LDCM0484  CL9 HCT 116 C191(0.71); C301(1.07); C341(1.07); C498(0.80)  LDD0801  [9]
 LDCM0485  CL90 HCT 116 C191(1.10); C301(1.17); C341(0.93); C498(1.08)  LDD0802  [9]
 LDCM0486  CL91 HCT 116 C301(1.08); C341(0.94); C498(0.95); C577(1.22)  LDD0803  [9]
 LDCM0487  CL92 HCT 116 C301(1.01); C341(0.88); C498(0.93); C577(1.24)  LDD0804  [9]
 LDCM0488  CL93 HCT 116 C301(0.91); C341(0.96); C498(1.16); C577(1.12)  LDD0805  [9]
 LDCM0489  CL94 HCT 116 C301(0.93); C341(0.85); C498(0.85); C577(0.97)  LDD0806  [9]
 LDCM0490  CL95 HCT 116 C301(0.93); C341(0.85); C498(0.89); C577(1.00)  LDD0807  [9]
 LDCM0491  CL96 HCT 116 C301(1.03); C341(0.89); C498(0.89); C577(0.99)  LDD0808  [9]
 LDCM0492  CL97 HCT 116 C301(0.96); C341(0.78); C498(0.80); C577(0.99)  LDD0809  [9]
 LDCM0493  CL98 HCT 116 C301(0.95); C341(0.88); C498(0.81); C577(0.91)  LDD0810  [9]
 LDCM0494  CL99 HCT 116 C301(1.01); C341(0.93); C498(0.88); C577(1.06)  LDD0811  [9]
 LDCM0495  E2913 HEK-293T C498(1.02); C640(1.14); C577(0.97); C82(1.02)  LDD1698  [26]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C640(2.66); C498(2.62); C82(2.54); C341(1.01)  LDD1702  [5]
 LDCM0175  Ethacrynic acid HeLa C640(1.05)  LDD2210  [7]
 LDCM0625  F8 Ramos C374(10.44)  LDD2187  [27]
 LDCM0572  Fragment10 MDA-MB-231 C640(3.27)  LDD1389  [28]
 LDCM0573  Fragment11 MDA-MB-231 C640(3.42)  LDD1391  [28]
 LDCM0576  Fragment14 MDA-MB-231 C640(1.19)  LDD1397  [28]
 LDCM0577  Fragment15 MDA-MB-231 C640(0.90)  LDD1399  [28]
 LDCM0579  Fragment20 MDA-MB-231 C640(2.08)  LDD1402  [28]
 LDCM0582  Fragment23 MDA-MB-231 C640(1.00)  LDD1408  [28]
 LDCM0584  Fragment25 MDA-MB-231 C640(1.01)  LDD1411  [28]
 LDCM0578  Fragment27 MDA-MB-231 C640(0.74)  LDD1401  [28]
 LDCM0587  Fragment29 MDA-MB-231 C640(0.86)  LDD1417  [28]
 LDCM0589  Fragment31 MDA-MB-231 C640(1.09)  LDD1421  [28]
 LDCM0590  Fragment32 MDA-MB-231 C640(12.88)  LDD1423  [28]
 LDCM0468  Fragment33 HCT 116 C191(0.77); C301(1.29); C341(0.83); C498(0.85)  LDD0785  [9]
 LDCM0596  Fragment38 MDA-MB-231 C640(1.12)  LDD1433  [28]
 LDCM0566  Fragment4 MDA-MB-231 C640(1.06)  LDD1378  [28]
 LDCM0601  Fragment43 MDA-MB-231 C640(6.38)  LDD1441  [28]
 LDCM0603  Fragment45 MDA-MB-231 C640(3.73)  LDD1444  [28]
 LDCM0604  Fragment46 MDA-MB-231 C640(0.78)  LDD1445  [28]
 LDCM0605  Fragment47 MDA-MB-231 C640(0.94)  LDD1446  [28]
 LDCM0606  Fragment48 MDA-MB-231 C640(0.96)  LDD1447  [28]
 LDCM0608  Fragment50 MDA-MB-231 C640(1.96)  LDD1449  [28]
 LDCM0427  Fragment51 HCT 116 C301(0.94); C341(0.67); C498(0.85); C577(0.80)  LDD0744  [9]
 LDCM0610  Fragment52 MDA-MB-231 C640(1.12)  LDD1452  [28]
 LDCM0614  Fragment56 MDA-MB-231 C640(0.99)  LDD1458  [28]
 LDCM0568  Fragment6 MDA-MB-231 C640(1.15)  LDD1382  [28]
 LDCM0570  Fragment8 MDA-MB-231 C640(3.26)  LDD1385  [28]
 LDCM0571  Fragment9 MDA-MB-231 C640(1.36)  LDD1387  [28]
 LDCM0116  HHS-0101 DM93 Y66(1.22)  LDD0264  [8]
 LDCM0117  HHS-0201 DM93 Y66(0.92)  LDD0265  [8]
 LDCM0118  HHS-0301 DM93 Y66(1.03)  LDD0266  [8]
 LDCM0119  HHS-0401 DM93 Y66(0.99)  LDD0267  [8]
 LDCM0120  HHS-0701 DM93 Y66(2.06)  LDD0268  [8]
 LDCM0107  IAA HeLa C341(0.00); C577(0.00); C640(0.00); C82(0.00)  LDD0221  [19]
 LDCM0022  KB02 HCT 116 C640(2.93); C301(1.38)  LDD0080  [9]
 LDCM0023  KB03 HCT 116 C640(3.37); C301(1.03)  LDD0081  [9]
 LDCM0024  KB05 HCT 116 C640(3.07); C301(1.42)  LDD0082  [9]
 LDCM0509  N-(4-bromo-3,5-dimethylphenyl)-2-nitroacetamide MDA-MB-231 C640(0.93)  LDD2102  [5]
 LDCM0528  N-(4-bromophenyl)-2-cyano-N-phenylacetamide MDA-MB-231 C640(0.57); C374(0.60); C82(1.00)  LDD2121  [5]
 LDCM0109  NEM HeLa H262(0.00); H21(0.00)  LDD0223  [19]
 LDCM0496  Nucleophilic fragment 11a MDA-MB-231 C341(1.03); C640(0.58); C374(0.51)  LDD2089  [5]
 LDCM0497  Nucleophilic fragment 11b MDA-MB-231 C640(1.27); C374(1.13); C82(1.03)  LDD2090  [5]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C640(0.88); C82(0.80)  LDD2092  [5]
 LDCM0500  Nucleophilic fragment 13a MDA-MB-231 C640(1.17); C82(1.10); C577(1.26)  LDD2093  [5]
 LDCM0501  Nucleophilic fragment 13b MDA-MB-231 C640(1.05); C82(1.07)  LDD2094  [5]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C640(0.73); C82(0.90)  LDD2096  [5]
 LDCM0504  Nucleophilic fragment 15a MDA-MB-231 C640(0.74)  LDD2097  [5]
 LDCM0505  Nucleophilic fragment 15b MDA-MB-231 C640(1.07); C374(0.15); C82(0.81)  LDD2098  [5]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C640(0.92); C498(1.12); C82(1.19); C577(1.94)  LDD2099  [5]
 LDCM0507  Nucleophilic fragment 16b MDA-MB-231 C640(1.02); C301(0.76)  LDD2100  [5]
 LDCM0508  Nucleophilic fragment 17a MDA-MB-231 C640(0.98)  LDD2101  [5]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C640(0.75); C82(0.68)  LDD2104  [5]
 LDCM0512  Nucleophilic fragment 19a MDA-MB-231 C640(1.29); C82(1.17)  LDD2105  [5]
 LDCM0513  Nucleophilic fragment 19b MDA-MB-231 C640(0.87); C82(0.52)  LDD2106  [5]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C640(0.95); C498(1.44); C82(1.20); C301(1.23)  LDD2107  [5]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C640(1.09); C82(0.64)  LDD2108  [5]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C640(0.85); C82(0.72); C577(0.70)  LDD2109  [5]
 LDCM0517  Nucleophilic fragment 21b MDA-MB-231 C640(1.20)  LDD2110  [5]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C640(1.09); C498(1.61); C82(1.04)  LDD2111  [5]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C341(0.72); C640(0.66); C82(0.53)  LDD2114  [5]
 LDCM0522  Nucleophilic fragment 24a MDA-MB-231 C640(0.49); C374(0.74)  LDD2115  [5]
 LDCM0523  Nucleophilic fragment 24b MDA-MB-231 C341(0.37); C640(1.00); C82(1.02)  LDD2116  [5]
 LDCM0525  Nucleophilic fragment 25b MDA-MB-231 C341(0.25); C640(1.01); C82(1.02); C577(0.35)  LDD2118  [5]
 LDCM0526  Nucleophilic fragment 26a MDA-MB-231 C640(1.89); C498(1.63); C577(1.46)  LDD2119  [5]
 LDCM0527  Nucleophilic fragment 26b MDA-MB-231 C640(0.78); C374(0.89); C82(0.95)  LDD2120  [5]
 LDCM0529  Nucleophilic fragment 27b MDA-MB-231 C341(0.24); C640(1.00); C82(1.09); C577(0.64)  LDD2122  [5]
 LDCM0530  Nucleophilic fragment 28a MDA-MB-231 C341(1.03); C640(1.17); C82(1.01); C577(1.55)  LDD2123  [5]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C341(0.31); C640(0.98); C82(1.01)  LDD2124  [5]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C640(0.92); C82(0.96); C301(1.22)  LDD2125  [5]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C341(0.14); C640(0.98); C82(0.94)  LDD2126  [5]
 LDCM0534  Nucleophilic fragment 30a MDA-MB-231 C640(1.28); C82(1.45); C577(1.31)  LDD2127  [5]
 LDCM0535  Nucleophilic fragment 30b MDA-MB-231 C640(0.80); C374(1.18); C82(0.94)  LDD2128  [5]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C640(1.02); C498(1.29); C82(1.11)  LDD2129  [5]
 LDCM0540  Nucleophilic fragment 35 MDA-MB-231 C640(0.49); C374(0.85); C82(0.47)  LDD2133  [5]
 LDCM0541  Nucleophilic fragment 36 MDA-MB-231 C640(0.34); C374(0.39); C82(0.45)  LDD2134  [5]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C640(1.68); C498(2.22); C82(1.69); C301(1.55)  LDD2135  [5]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C640(1.31); C498(1.17); C82(1.41)  LDD2136  [5]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C640(1.06); C498(1.29); C82(0.99); C577(1.66)  LDD2137  [5]
 LDCM0211  Nucleophilic fragment 3b MDA-MB-231 C640(2.36); C82(2.26); C374(1.88)  LDD1700  [5]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C640(0.75); C82(0.75)  LDD2140  [5]
 LDCM0547  Nucleophilic fragment 41 MDA-MB-231 C640(0.76); C82(0.82)  LDD2141  [5]
 LDCM0549  Nucleophilic fragment 43 MDA-MB-231 C640(0.80); C374(1.09); C82(0.85)  LDD2143  [5]
 LDCM0550  Nucleophilic fragment 5a MDA-MB-231 C640(1.74); C498(1.74); C82(1.68); C577(1.80)  LDD2144  [5]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C640(0.90); C82(1.03); C577(1.13)  LDD2146  [5]
 LDCM0553  Nucleophilic fragment 6b MDA-MB-231 C640(1.34); C374(4.04); C82(2.41)  LDD2147  [5]
 LDCM0554  Nucleophilic fragment 7a MDA-MB-231 C640(0.56); C374(1.01); C82(0.55); C577(2.42)  LDD2148  [5]
 LDCM0555  Nucleophilic fragment 7b MDA-MB-231 C341(0.22); C640(1.57); C82(1.08)  LDD2149  [5]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C341(0.68); C640(0.49); C82(0.71)  LDD2150  [5]
 LDCM0557  Nucleophilic fragment 8b MDA-MB-231 C341(0.36); C640(0.99); C374(0.60); C82(1.07)  LDD2151  [5]
 LDCM0559  Nucleophilic fragment 9b MDA-MB-231 C640(1.40); C374(0.84); C82(1.62)  LDD2153  [5]
 LDCM0628  OTUB2-COV-1 HEK-293T C301(1.09)  LDD2207  [29]
 LDCM0131  RA190 MM1.R C301(1.22); C39(1.16)  LDD0304  [30]
 LDCM0021  THZ1 HCT 116 C301(1.16); C577(1.08); C640(1.14)  LDD2173  [9]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Enzyme
Click To Hide/Show 4 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Palmitoyltransferase ZDHHC17 (ZDHHC17) DHHC palmitoyltransferase family Q8IUH5
Caspase-6 (CASP6) Peptidase C14A family P55212
Protein disulfide-isomerase (P4HB) Protein disulfide isomerase family P07237
GTP-binding nuclear protein Ran (RAN) Ran family P62826
Other
Click To Hide/Show 2 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Nuclear protein 1 (NUPR1) NUPR family O60356
Calpain small subunit 1 (CAPNS1) . P04632

The Drug(s) Related To This Target

Phase 1
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Abt-957 . D03NLQ
Investigative
Click To Hide/Show 12 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
(1-benzyl-2-oxo-ethyl)-carbamic Acid Benzyl Ester Small molecular drug D0N6QM
3-(1h-pyrrol-3-yl)-propionamide Small molecular drug D01HUQ
Aw-00430 Small molecular drug D0W9ZV
Calpastatin Small molecular drug D08TCW
Dihydroxanthohumol Small molecular drug D0L2AO
Gnf-pf-4453 Small molecular drug D0G0HK
Mercaptoacrylate Inhibitor Of Calpain 1 Small molecular drug D0S9XO
N-(1-benzyl-2-oxo-ethyl)-benzamide Small molecular drug D00JPH
Pmid20690647c4b Small molecular drug D07ZYE
Pmid20690647c5a Small molecular drug D0T4FT
Pmid8831774c19 Small molecular drug D03UYO
A-558693 . D03GAN
Patented
Click To Hide/Show 19 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
5-azolone Derivative 1 Small molecular drug D0U2JU
Carboxamide Derivative 10 Small molecular drug D09CGG
Carboxamide Derivative 11 Small molecular drug D0C4YX
Carboxamide Derivative 5 Small molecular drug D0XC2D
Carboxamide Derivative 6 Small molecular drug D0H0LO
Carboxamide Derivative 7 Small molecular drug D06JCF
Carboxamide Derivative 8 Small molecular drug D0CO2G
Carboxamide Derivative 9 Small molecular drug D0X9DL
Epoxysuccinate Derivative 1 Small molecular drug D0OI2F
Epoxysuccinate Derivative 10 Small molecular drug D0FG4C
Epoxysuccinate Derivative 2 Small molecular drug D0HZ1Z
Epoxysuccinate Derivative 3 Small molecular drug D0WS4U
Epoxysuccinate Derivative 4 Small molecular drug D05LZV
Epoxysuccinate Derivative 5 Small molecular drug D0L3RN
Epoxysuccinate Derivative 6 Small molecular drug D0KA3L
Epoxysuccinate Derivative 7 Small molecular drug D08CGI
Epoxysuccinate Derivative 8 Small molecular drug D0IO8Y
Epoxysuccinate Derivative 9 Small molecular drug D03ZOR
Pmid25399719-compound-17 Small molecular drug D06LLT
Withdrawn from market
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Bithionol Small molecular drug D0QQ1J
Discontinued
Click To Hide/Show 4 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Ak-295 Small molecular drug D00QHT
Aloxistatin Small molecular drug D0NJ1A
Mdl-28170 Small molecular drug D0G5ZE
Sja-6017 Small molecular drug D06VTU

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 Comparison of Different Competitive Proteome Profiling Approaches in Target Identification of Covalent Inhibitors. Chembiochem. 2022 Dec 16;23(24):e202200389. doi: 10.1002/cbic.202200389. Epub 2022 Nov 22.
3 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.
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 Nucleophilic covalent ligand discovery for the cysteine redoxome. Nat Chem Biol. 2023 Nov;19(11):1309-1319. doi: 10.1038/s41589-023-01330-5. Epub 2023 May 29.
Mass spectrometry data entry: PXD039908 , PXD029761
6 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 Discovery of a Cell-Active SuTEx Ligand of Prostaglandin Reductase 2. Chembiochem. 2021 Jun 15;22(12):2134-2139. doi: 10.1002/cbic.202000879. Epub 2021 Apr 29.
9 Reimagining high-throughput profiling of reactive cysteines for cell-based screening of large electrophile libraries. Nat Biotechnol. 2021 May;39(5):630-641. doi: 10.1038/s41587-020-00778-3. Epub 2021 Jan 4.
10 Targeted Proteomic Approaches for Proteome-Wide Characterizations of the AMP-Binding Capacities of Kinases. J Proteome Res. 2022 Aug 5;21(8):2063-2070. doi: 10.1021/acs.jproteome.2c00225. Epub 2022 Jul 12.
11 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
12 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
13 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
14 A modification-centric assessment tool for the performance of chemoproteomic probes. Nat Chem Biol. 2022 Aug;18(8):904-912. doi: 10.1038/s41589-022-01074-8. Epub 2022 Jul 21.
Mass spectrometry data entry: PXD027758 , PXD027755 , PXD027760 , PXD027762 , PXD027756 , PXD027591 , PXD007149 , PXD030064 , PXD032392 , PXD027789 , PXD027767 , PXD027764
15 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
16 Chemoproteomic Profiling by Cysteine Fluoroalkylation Reveals Myrocin G as an Inhibitor of the Nonhomologous End Joining DNA Repair Pathway. J Am Chem Soc. 2021 Dec 8;143(48):20332-20342. doi: 10.1021/jacs.1c09724. Epub 2021 Nov 24.
Mass spectrometry data entry: PXD029255
17 DFT-Guided Discovery of Ethynyl-Triazolyl-Phosphinates as Modular Electrophiles for Chemoselective Cysteine Bioconjugation and Profiling. Angew Chem Int Ed Engl. 2022 Oct 10;61(41):e202205348. doi: 10.1002/anie.202205348. Epub 2022 Aug 22.
Mass spectrometry data entry: PXD033004
18 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.
19 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.
20 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.
21 Global profiling identifies a stress-responsive tyrosine site on EDC3 regulating biomolecular condensate formation. Cell Chem Biol. 2022 Dec 15;29(12):1709-1720.e7. doi: 10.1016/j.chembiol.2022.11.008. Epub 2022 Dec 6.
Mass spectrometry data entry: PXD038010
22 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
23 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.
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Mass spectrometry data entry: PXD044402
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Mass spectrometry data entry: PXD027578
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