Details of the Target

General Information of Target

Target ID LDTP02204
Target Name Calpain-1 catalytic subunit (CAPN1)
Gene Name CAPN1
Gene ID 823
Synonyms
CANPL1; Calpain-1 catalytic subunit; EC 3.4.22.52; Calcium-activated neutral proteinase 1; CANP 1; Calpain mu-type; Calpain-1 large subunit; Cell proliferation-inducing gene 30 protein; Micromolar-calpain; muCANP
3D Structure
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2D Sequence (FASTA)
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3D Structure (PDB)
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Sequence
MSEEIITPVYCTGVSAQVQKQRARELGLGRHENAIKYLGQDYEQLRVRCLQSGTLFRDEA
FPPVPQSLGYKDLGPNSSKTYGIKWKRPTELLSNPQFIVDGATRTDICQGALGDCWLLAA
IASLTLNDTLLHRVVPHGQSFQNGYAGIFHFQLWQFGEWVDVVVDDLLPIKDGKLVFVHS
AEGNEFWSALLEKAYAKVNGSYEALSGGSTSEGFEDFTGGVTEWYELRKAPSDLYQIILK
ALERGSLLGCSIDISSVLDMEAITFKKLVKGHAYSVTGAKQVNYRGQVVSLIRMRNPWGE
VEWTGAWSDSSSEWNNVDPYERDQLRVKMEDGEFWMSFRDFMREFTRLEICNLTPDALKS
RTIRKWNTTLYEGTWRRGSTAGGCRNYPATFWVNPQFKIRLDETDDPDDYGDRESGCSFV
LALMQKHRRRERRFGRDMETIGFAVYEVPPELVGQPAVHLKRDFFLANASRARSEQFINL
REVSTRFRLPPGEYVVVPSTFEPNKEGDFVLRFFSEKSAGTVELDDQIQANLPDEQVLSE
EEIDENFKALFRQLAGEDMEISVKELRTILNRIISKHKDLRTKGFSLESCRSMVNLMDRD
GNGKLGLVEFNILWNRIRNYLSIFRKFDLDKSGSMSAYEMRMAIESAGFKLNKKLYELII
TRYSEPDLAVDFDNFVCCLVRLETMFRFFKTLDTDLDGVVTFDLFKWLQLTMFA
Target Type
Patented-recorded
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 CTBP1 at 'Asn-375', 'Gly-387' and 'His-409'. Cleaves and activates caspase-7 (CASP7).
TTD ID
T92517
Uniprot ID
P07384
DrugMap ID
TT1WBIJ
Ensemble ID
ENST00000279247.11
HGNC ID
HGNC:1476
ChEMBL ID
CHEMBL3891

Probe(s) Labeling This Target

ABPP Probe
Click To Hide/Show 34 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
m-APA
 Probe Info  		13.06  LDD0402  [1]
A-EBA
 Probe Info  		3.87  LDD0215  [2]
AZ-9
 Probe Info  		6.94  LDD0393  [3]
CY-1
 Probe Info  		100.00  LDD0243  [4]
CY4
 Probe Info  		100.00  LDD0244  [4]
N1
 Probe Info  		100.00  LDD0242  [4]
YN-1
 Probe Info  		100.00  LDD0444  [5]
STPyne
 Probe Info  		K20(8.82); K229(9.19); K270(5.88); K365(7.78)  LDD0277  [6]
Probe 1
 Probe Info  		Y37(42.04); Y42(10.69); Y274(31.37); Y410(17.59)  LDD3495  [7]
JZ128-DTB
 Probe Info  		N.A.  LDD0462  [8]
BTD
 Probe Info  		C49(0.79)  LDD2092  [9]
AHL-Pu-1
 Probe Info  		C384(2.25)  LDD0168  [10]
DBIA
 Probe Info  		C384(0.90)  LDD0078  [11]
ATP probe
 Probe Info  		N.A.  LDD0199  [12]
4-Iodoacetamidophenylacetylene
 Probe Info  		C49(0.00); C417(0.00); C590(0.00); C384(0.00)  LDD0038  [13]
IA-alkyne
 Probe Info  		C49(0.00); C417(0.00); C590(0.00); C351(0.00)  LDD0036  [13]
IPIAA_L
 Probe Info  		N.A.  LDD0031  [14]
Lodoacetamide azide
 Probe Info  		C49(0.00); C417(0.00); C590(0.00); C250(0.00)  LDD0037  [13]
IPM
 Probe Info  		N.A.  LDD0025  [15]
JW-RF-010
 Probe Info  		N.A.  LDD0026  [15]
TFBX
 Probe Info  		N.A.  LDD0027  [15]
WYneN
 Probe Info  		C351(0.00); C384(0.00)  LDD0021  [16]
WYneO
 Probe Info  		N.A.  LDD0022  [16]
Compound 10
 Probe Info  		N.A.  LDD2216  [17]
Compound 11
 Probe Info  		N.A.  LDD2213  [17]
PF-06672131
 Probe Info  		C11(0.00); C351(0.00)  LDD0017  [18]
VSF
 Probe Info  		N.A.  LDD0007  [16]
Acrolein
 Probe Info  		C351(0.00); C384(0.00)  LDD0217  [19]
Methacrolein
 Probe Info  		N.A.  LDD0218  [19]
W1
 Probe Info  		C351(0.00); C417(0.00)  LDD0236  [20]
MPP-AC
 Probe Info  		N.A.  LDD0428  [21]
NAIA_5
 Probe Info  		C49(0.00); C351(0.00); C417(0.00); C384(0.00)  LDD2223  [22]
TER-AC
 Probe Info  		N.A.  LDD0426  [21]
HHS-482
 Probe Info  		Y387(0.56)  LDD2239  [23]
PAL-AfBPP Probe
Click To Hide/Show 5 Probe Related to This Target
Probe name Structure Binding Site(Ratio) Interaction ID Ref
C277
 Probe Info  		8.11  LDD1947  [24]
C422
 Probe Info  		8.82  LDD2077  [24]
FFF probe14
 Probe Info  		6.48  LDD0477  [25]
STS-1
 Probe Info  		N.A.  LDD0136  [26]
DA-2
 Probe Info  		N.A.  LDD0073  [27]

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 C351(0.22)  LDD2142  [9]
 LDCM0519  1-(6-methoxy-3,4-dihydroquinolin-1(2H)-yl)-2-nitroethan-1-one MDA-MB-231 C351(0.48)  LDD2112  [9]
 LDCM0524  2-Cyano-N-(2-morpholin-4-yl-ethyl)-acetamide MDA-MB-231 C351(0.88)  LDD2117  [9]
 LDCM0025  4SU-RNA HEK-293T C384(2.25)  LDD0168  [10]
 LDCM0026  4SU-RNA+native RNA HEK-293T C384(20.00)  LDD0169  [10]
 LDCM0214  AC1 HCT 116 C351(1.36); C384(0.81); C417(0.62); C49(0.97)  LDD0531  [11]
 LDCM0215  AC10 HCT 116 C351(1.32); C384(1.92); C417(0.52); C49(1.24)  LDD0532  [11]
 LDCM0216  AC100 HCT 116 C351(0.88); C417(0.70); C49(0.80); C590(0.89)  LDD0533  [11]
 LDCM0217  AC101 HCT 116 C351(0.73); C417(0.68); C49(0.85); C590(0.69)  LDD0534  [11]
 LDCM0218  AC102 HCT 116 C351(0.97); C417(0.66); C49(0.59); C590(0.71)  LDD0535  [11]
 LDCM0219  AC103 HCT 116 C351(0.78); C417(0.64); C49(0.32); C590(0.61)  LDD0536  [11]
 LDCM0220  AC104 HCT 116 C351(1.02); C417(0.61); C49(0.50); C590(0.67)  LDD0537  [11]
 LDCM0221  AC105 HCT 116 C351(0.92); C417(0.58); C49(0.37); C590(0.59)  LDD0538  [11]
 LDCM0222  AC106 HCT 116 C351(1.06); C417(0.62); C49(0.45); C590(0.67)  LDD0539  [11]
 LDCM0223  AC107 HCT 116 C351(0.84); C417(0.60); C49(0.42); C590(0.62)  LDD0540  [11]
 LDCM0224  AC108 HCT 116 C351(0.78); C417(0.72); C49(0.79); C590(0.82)  LDD0541  [11]
 LDCM0225  AC109 HCT 116 C351(1.15); C417(0.68); C49(0.76); C590(0.91)  LDD0542  [11]
 LDCM0226  AC11 HCT 116 C351(1.36); C384(1.57); C417(0.47); C49(1.09)  LDD0543  [11]
 LDCM0227  AC110 HCT 116 C351(0.94); C417(0.75); C49(0.64); C590(0.76)  LDD0544  [11]
 LDCM0228  AC111 HCT 116 C351(0.68); C417(0.59); C49(0.57); C590(0.69)  LDD0545  [11]
 LDCM0229  AC112 HCT 116 C351(0.69); C417(0.55); C49(0.44); C590(0.58)  LDD0546  [11]
 LDCM0230  AC113 HCT 116 C351(0.86); C384(0.94); C49(1.19); C590(1.02)  LDD0547  [11]
 LDCM0231  AC114 HCT 116 C351(0.39); C384(0.83); C49(0.91); C590(0.94)  LDD0548  [11]
 LDCM0232  AC115 HCT 116 C351(0.33); C384(1.14); C49(1.02); C590(0.85)  LDD0549  [11]
 LDCM0233  AC116 HCT 116 C351(0.34); C384(1.39); C49(0.98); C590(0.91)  LDD0550  [11]
 LDCM0234  AC117 HCT 116 C351(0.45); C384(1.22); C49(0.97); C590(1.30)  LDD0551  [11]
 LDCM0235  AC118 HCT 116 C351(0.62); C384(1.21); C49(1.16); C590(1.16)  LDD0552  [11]
 LDCM0236  AC119 HCT 116 C351(0.43); C384(0.93); C49(1.09); C590(0.99)  LDD0553  [11]
 LDCM0237  AC12 HCT 116 C351(1.81); C384(1.73); C417(0.72); C49(1.57)  LDD0554  [11]
 LDCM0238  AC120 HCT 116 C351(0.37); C384(1.05); C49(1.25); C590(1.05)  LDD0555  [11]
 LDCM0239  AC121 HCT 116 C351(0.71); C384(1.74); C49(0.96); C590(1.17)  LDD0556  [11]
 LDCM0240  AC122 HCT 116 C351(0.61); C384(1.24); C49(1.09); C590(0.95)  LDD0557  [11]
 LDCM0241  AC123 HCT 116 C351(0.80); C384(0.92); C49(0.78); C590(0.84)  LDD0558  [11]
 LDCM0242  AC124 HCT 116 C351(0.76); C384(0.93); C49(1.02); C590(1.12)  LDD0559  [11]
 LDCM0243  AC125 HCT 116 C351(0.59); C384(0.97); C49(1.08); C590(0.97)  LDD0560  [11]
 LDCM0244  AC126 HCT 116 C351(0.33); C384(1.12); C49(0.88); C590(1.40)  LDD0561  [11]
 LDCM0245  AC127 HCT 116 C351(0.34); C384(1.60); C49(0.89); C590(1.07)  LDD0562  [11]
 LDCM0246  AC128 HCT 116 C351(1.29); C384(0.80); C417(0.85); C49(1.11)  LDD0563  [11]
 LDCM0247  AC129 HCT 116 C351(1.31); C384(0.75); C417(1.23); C49(1.80)  LDD0564  [11]
 LDCM0249  AC130 HCT 116 C351(1.34); C384(1.31); C417(0.81); C49(1.07)  LDD0566  [11]
 LDCM0250  AC131 HCT 116 C351(1.21); C384(0.92); C417(1.54); C49(1.76)  LDD0567  [11]
 LDCM0251  AC132 HCT 116 C351(1.13); C384(0.92); C417(1.01); C49(1.75)  LDD0568  [11]
 LDCM0252  AC133 HCT 116 C351(1.20); C384(0.95); C417(0.78); C49(1.12)  LDD0569  [11]
 LDCM0253  AC134 HCT 116 C351(0.94); C384(0.95); C417(0.88); C49(0.90)  LDD0570  [11]
 LDCM0254  AC135 HCT 116 C351(1.10); C384(0.79); C417(0.83); C49(1.12)  LDD0571  [11]
 LDCM0255  AC136 HCT 116 C351(0.93); C384(0.85); C417(0.84); C49(1.00)  LDD0572  [11]
 LDCM0256  AC137 HCT 116 C351(1.14); C384(0.79); C417(0.99); C49(1.17)  LDD0573  [11]
 LDCM0257  AC138 HCT 116 C351(0.81); C384(0.63); C417(0.78); C49(1.11)  LDD0574  [11]
 LDCM0258  AC139 HCT 116 C351(0.79); C384(0.47); C417(0.90); C49(1.13)  LDD0575  [11]
 LDCM0259  AC14 HCT 116 C351(1.48); C384(1.43); C417(0.49); C49(1.19)  LDD0576  [11]
 LDCM0260  AC140 HCT 116 C351(0.71); C384(0.53); C417(0.87); C49(0.80)  LDD0577  [11]
 LDCM0261  AC141 HCT 116 C351(0.67); C384(0.64); C417(0.90); C49(1.14)  LDD0578  [11]
 LDCM0262  AC142 HCT 116 C351(0.93); C384(0.53); C417(1.10); C49(1.43)  LDD0579  [11]
 LDCM0263  AC143 HCT 116 C351(0.79); C384(1.53); C417(0.81); C49(0.73)  LDD0580  [11]
 LDCM0264  AC144 HCT 116 C417(0.38); C590(0.53); C351(0.66); C384(0.66)  LDD0581  [11]
 LDCM0265  AC145 HCT 116 C417(0.52); C590(0.60); C384(0.66); C351(0.76)  LDD0582  [11]
 LDCM0266  AC146 HCT 116 C417(0.37); C351(0.50); C590(0.60); C49(0.81)  LDD0583  [11]
 LDCM0267  AC147 HCT 116 C417(0.41); C590(0.49); C351(0.78); C384(0.79)  LDD0584  [11]
 LDCM0268  AC148 HCT 116 C351(0.44); C417(0.44); C590(0.49); C49(0.78)  LDD0585  [11]
 LDCM0269  AC149 HCT 116 C417(0.36); C351(0.45); C590(0.54); C49(0.73)  LDD0586  [11]
 LDCM0270  AC15 HCT 116 C417(0.51); C677(0.77); C678(0.77); C590(0.81)  LDD0587  [11]
 LDCM0271  AC150 HCT 116 C417(0.54); C590(0.63); C351(0.69); C49(0.96)  LDD0588  [11]
 LDCM0272  AC151 HCT 116 C590(0.52); C417(0.61); C384(0.70); C351(0.77)  LDD0589  [11]
 LDCM0273  AC152 HCT 116 C417(0.40); C590(0.50); C351(0.50); C49(0.77)  LDD0590  [11]
 LDCM0274  AC153 HCT 116 C351(0.37); C417(0.38); C590(0.51); C49(0.64)  LDD0591  [11]
 LDCM0621  AC154 HCT 116 C351(0.53); C384(0.97); C417(0.42); C49(0.83)  LDD2158  [11]
 LDCM0622  AC155 HCT 116 C351(0.46); C384(1.01); C417(0.43); C49(0.79)  LDD2159  [11]
 LDCM0623  AC156 HCT 116 C351(0.77); C384(1.03); C417(0.82); C49(0.84)  LDD2160  [11]
 LDCM0624  AC157 HCT 116 C351(0.84); C384(1.28); C417(1.01); C49(0.73)  LDD2161  [11]
 LDCM0276  AC17 HCT 116 C417(0.85); C49(0.98); C590(1.11); C384(1.13)  LDD0593  [11]
 LDCM0277  AC18 HCT 116 C417(0.60); C590(0.97); C384(1.15); C49(1.36)  LDD0594  [11]
 LDCM0278  AC19 HCT 116 C417(0.60); C590(0.95); C384(1.25); C49(1.27)  LDD0595  [11]
 LDCM0279  AC2 HCT 116 C417(0.59); C590(0.79); C384(0.82); C678(0.98)  LDD0596  [11]
 LDCM0280  AC20 HCT 116 C417(0.76); C49(0.91); C384(1.01); C590(1.03)  LDD0597  [11]
 LDCM0281  AC21 HCT 116 C417(0.99); C590(1.03); C384(1.10); C49(1.22)  LDD0598  [11]
 LDCM0282  AC22 HCT 116 C417(0.68); C590(0.99); C49(1.00); C384(1.18)  LDD0599  [11]
 LDCM0283  AC23 HCT 116 C417(0.67); C590(1.00); C49(1.07); C384(1.62)  LDD0600  [11]
 LDCM0284  AC24 HCT 116 C49(0.86); C417(0.90); C590(1.03); C384(1.33)  LDD0601  [11]
 LDCM0285  AC25 HCT 116 C351(0.87); C417(0.95); C590(0.97); C49(1.10)  LDD0602  [11]
 LDCM0286  AC26 HCT 116 C351(0.70); C49(0.74); C417(0.80); C590(0.86)  LDD0603  [11]
 LDCM0287  AC27 HCT 116 C351(0.66); C417(0.76); C49(0.78); C590(0.87)  LDD0604  [11]
 LDCM0288  AC28 HCT 116 C351(0.65); C417(0.80); C590(0.81); C49(0.82)  LDD0605  [11]
 LDCM0289  AC29 HCT 116 C351(0.57); C49(0.68); C590(0.74); C417(0.83)  LDD0606  [11]
 LDCM0290  AC3 HCT 116 C417(0.61); C678(0.77); C590(0.80); C384(0.85)  LDD0607  [11]
 LDCM0291  AC30 HCT 116 C351(0.51); C49(0.57); C590(0.62); C417(0.76)  LDD0608  [11]
 LDCM0292  AC31 HCT 116 C351(0.65); C49(0.68); C590(0.71); C417(0.79)  LDD0609  [11]
 LDCM0293  AC32 HCT 116 C49(0.43); C351(0.49); C590(0.58); C417(0.68)  LDD0610  [11]
 LDCM0294  AC33 HCT 116 C351(0.58); C590(0.73); C417(0.73); C49(0.89)  LDD0611  [11]
 LDCM0295  AC34 HCT 116 C351(0.52); C49(0.56); C417(0.74); C590(0.74)  LDD0612  [11]
 LDCM0296  AC35 HCT 116 C417(1.04); C351(1.20); C590(1.26); C49(1.31)  LDD0613  [11]
 LDCM0297  AC36 HCT 116 C351(0.88); C417(0.98); C49(1.04); C590(1.11)  LDD0614  [11]
 LDCM0298  AC37 HCT 116 C351(0.85); C417(0.94); C590(1.10); C49(1.71)  LDD0615  [11]
 LDCM0299  AC38 HCT 116 C351(0.82); C49(0.95); C590(0.98); C417(1.07)  LDD0616  [11]
 LDCM0300  AC39 HCT 116 C417(0.87); C590(0.93); C351(1.04); C49(1.14)  LDD0617  [11]
 LDCM0301  AC4 HCT 116 C417(0.45); C678(0.72); C590(0.80); C677(0.84)  LDD0618  [11]
 LDCM0302  AC40 HCT 116 C351(0.73); C417(0.90); C590(0.98); C49(0.98)  LDD0619  [11]
 LDCM0303  AC41 HCT 116 C351(0.41); C590(0.88); C417(0.90); C49(0.91)  LDD0620  [11]
 LDCM0304  AC42 HCT 116 C351(0.59); C590(0.87); C49(0.89); C417(0.97)  LDD0621  [11]
 LDCM0305  AC43 HCT 116 C351(0.50); C590(0.78); C417(0.89); C49(0.97)  LDD0622  [11]
 LDCM0306  AC44 HCT 116 C351(0.42); C417(0.89); C590(0.98); C49(1.30)  LDD0623  [11]
 LDCM0307  AC45 HCT 116 C351(0.44); C590(0.82); C417(0.93); C49(1.46)  LDD0624  [11]
 LDCM0308  AC46 HCT 116 C49(0.53); C384(0.60); C417(0.97); C590(1.05)  LDD0625  [11]
 LDCM0309  AC47 HCT 116 C49(0.67); C417(0.87); C384(0.87); C590(1.29)  LDD0626  [11]
 LDCM0310  AC48 HCT 116 C49(0.62); C384(0.72); C590(0.95); C417(0.99)  LDD0627  [11]
 LDCM0311  AC49 HCT 116 C384(0.68); C590(0.74); C49(0.87); C417(1.01)  LDD0628  [11]
 LDCM0312  AC5 HCT 116 C417(0.40); C678(0.69); C590(0.75); C677(0.87)  LDD0629  [11]
 LDCM0313  AC50 HCT 116 C49(0.57); C384(0.68); C590(0.77); C417(0.84)  LDD0630  [11]
 LDCM0314  AC51 HCT 116 C49(0.59); C384(0.70); C417(1.24); C590(1.67)  LDD0631  [11]
 LDCM0315  AC52 HCT 116 C384(0.58); C49(0.58); C417(0.83); C590(1.12)  LDD0632  [11]
 LDCM0316  AC53 HCT 116 C384(0.72); C49(0.79); C590(0.83); C417(0.87)  LDD0633  [11]
 LDCM0317  AC54 HCT 116 C49(0.62); C384(0.67); C590(0.91); C417(1.02)  LDD0634  [11]
 LDCM0318  AC55 HCT 116 C417(0.81); C590(0.84); C49(0.84); C384(1.40)  LDD0635  [11]
 LDCM0319  AC56 HCT 116 C49(0.48); C590(0.72); C384(0.79); C417(0.82)  LDD0636  [11]
 LDCM0320  AC57 HCT 116 C417(0.58); C590(0.64); C351(0.85); C49(0.95)  LDD0637  [11]
 LDCM0321  AC58 HCT 116 C417(0.50); C590(0.68); C351(0.76); C49(0.87)  LDD0638  [11]
 LDCM0322  AC59 HCT 116 C351(0.57); C417(0.66); C590(0.67); C49(0.93)  LDD0639  [11]
 LDCM0323  AC6 HCT 116 C417(0.55); C590(0.78); C677(0.80); C678(0.80)  LDD0640  [11]
 LDCM0324  AC60 HCT 116 C590(0.56); C351(0.62); C417(0.66); C49(0.99)  LDD0641  [11]
 LDCM0325  AC61 HCT 116 C417(0.56); C590(0.60); C351(0.68); C49(0.91)  LDD0642  [11]
 LDCM0326  AC62 HCT 116 C590(0.61); C351(0.67); C417(0.77); C49(0.94)  LDD0643  [11]
 LDCM0327  AC63 HCT 116 C351(0.71); C417(0.74); C590(0.74); C49(1.09)  LDD0644  [11]
 LDCM0328  AC64 HCT 116 C590(0.63); C351(0.64); C417(0.71); C49(0.80)  LDD0645  [11]
 LDCM0329  AC65 HCT 116 C417(0.48); C590(0.63); C351(0.73); C384(0.79)  LDD0646  [11]
 LDCM0330  AC66 HCT 116 C417(0.50); C590(0.66); C384(0.69); C351(0.73)  LDD0647  [11]
 LDCM0331  AC67 HCT 116 C417(0.52); C351(0.53); C590(0.58); C49(0.74)  LDD0648  [11]
 LDCM0332  AC68 HCT 116 C417(0.72); C49(0.73); C384(0.88); C590(0.97)  LDD0649  [11]
 LDCM0333  AC69 HCT 116 C417(0.72); C49(0.88); C384(0.98); C351(1.13)  LDD0650  [11]
 LDCM0334  AC7 HCT 116 C417(0.70); C590(0.95); C49(1.02); C351(1.16)  LDD0651  [11]
 LDCM0335  AC70 HCT 116 C417(0.64); C384(0.73); C49(0.80); C590(0.97)  LDD0652  [11]
 LDCM0336  AC71 HCT 116 C49(0.92); C417(0.93); C590(1.22); C351(1.32)  LDD0653  [11]
 LDCM0337  AC72 HCT 116 C417(0.63); C384(0.83); C49(0.85); C590(0.92)  LDD0654  [11]
 LDCM0338  AC73 HCT 116 C417(0.65); C49(0.72); C384(0.83); C590(0.99)  LDD0655  [11]
 LDCM0339  AC74 HCT 116 C49(0.79); C417(0.80); C384(1.00); C351(1.10)  LDD0656  [11]
 LDCM0340  AC75 HCT 116 C417(0.65); C384(0.71); C49(0.90); C590(0.99)  LDD0657  [11]
 LDCM0341  AC76 HCT 116 C49(0.89); C417(0.90); C384(1.19); C351(1.28)  LDD0658  [11]
 LDCM0342  AC77 HCT 116 C384(0.74); C417(0.75); C49(0.89); C590(0.90)  LDD0659  [11]
 LDCM0343  AC78 HCT 116 C417(0.77); C351(1.05); C49(1.09); C590(1.10)  LDD0660  [11]
 LDCM0344  AC79 HCT 116 C417(0.69); C384(0.78); C49(0.88); C590(1.10)  LDD0661  [11]
 LDCM0345  AC8 HCT 116 C417(0.57); C590(0.87); C677(0.95); C678(0.95)  LDD0662  [11]
 LDCM0346  AC80 HCT 116 C49(0.75); C384(0.86); C417(0.90); C351(1.00)  LDD0663  [11]
 LDCM0347  AC81 HCT 116 C417(0.74); C384(0.76); C590(0.94); C49(1.14)  LDD0664  [11]
 LDCM0348  AC82 HCT 116 C417(0.70); C49(0.74); C351(1.00); C384(1.30)  LDD0665  [11]
 LDCM0349  AC83 HCT 116 C417(0.55); C590(0.79); C351(0.85); C49(0.98)  LDD0666  [11]
 LDCM0350  AC84 HCT 116 C417(0.60); C590(0.72); C351(0.74); C49(0.89)  LDD0667  [11]
 LDCM0351  AC85 HCT 116 C417(0.64); C590(0.80); C351(0.80); C384(1.08)  LDD0668  [11]
 LDCM0352  AC86 HCT 116 C351(0.73); C417(0.73); C590(0.74); C384(0.98)  LDD0669  [11]
 LDCM0353  AC87 HCT 116 C351(0.71); C590(0.74); C417(1.05); C49(1.07)  LDD0670  [11]
 LDCM0354  AC88 HCT 116 C417(0.70); C351(0.75); C590(0.90); C384(1.08)  LDD0671  [11]
 LDCM0355  AC89 HCT 116 C417(0.64); C351(0.74); C590(0.82); C384(1.11)  LDD0672  [11]
 LDCM0357  AC90 HCT 116 C351(0.70); C590(0.70); C384(1.17); C417(1.28)  LDD0674  [11]
 LDCM0358  AC91 HCT 116 C417(0.54); C590(0.84); C351(0.91); C49(1.15)  LDD0675  [11]
 LDCM0359  AC92 HCT 116 C417(0.58); C590(0.85); C351(0.90); C384(1.06)  LDD0676  [11]
 LDCM0360  AC93 HCT 116 C417(0.74); C351(0.79); C590(0.87); C49(1.16)  LDD0677  [11]
 LDCM0361  AC94 HCT 116 C417(0.78); C590(0.85); C384(1.00); C351(1.38)  LDD0678  [11]
 LDCM0362  AC95 HCT 116 C351(0.76); C590(0.86); C417(1.11); C384(1.23)  LDD0679  [11]
 LDCM0363  AC96 HCT 116 C417(0.66); C590(0.88); C351(1.11); C384(1.16)  LDD0680  [11]
 LDCM0364  AC97 HCT 116 C417(0.59); C351(0.59); C590(0.69); C49(1.01)  LDD0681  [11]
 LDCM0365  AC98 HCT 116 C49(0.21); C590(0.42); C417(0.55); C351(0.65)  LDD0682  [11]
 LDCM0366  AC99 HCT 116 C351(0.77); C590(0.78); C49(0.97); C417(0.97)  LDD0683  [11]
 LDCM0248  AKOS034007472 HCT 116 C351(1.37); C384(1.27); C417(0.83); C49(1.23)  LDD0565  [11]
 LDCM0356  AKOS034007680 HCT 116 C417(0.56); C677(0.82); C678(0.82); C590(0.86)  LDD0673  [11]
 LDCM0275  AKOS034007705 HCT 116 C417(0.41); C677(0.60); C678(0.60); C590(0.69)  LDD0592  [11]
 LDCM0156  Aniline NCI-H1299 11.39  LDD0403  [1]
 LDCM0020  ARS-1620 HCC44 C384(0.90)  LDD0078  [11]
 LDCM0630  CCW28-3 231MFP C115(1.31)  LDD2214  [28]
 LDCM0108  Chloroacetamide HeLa C351(0.00); C590(0.00); C384(0.00)  LDD0222  [19]
 LDCM0632  CL-Sc Hep-G2 C351(0.65)  LDD2227  [22]
 LDCM0367  CL1 HCT 116 C384(0.94); C677(0.96); C49(1.06); C351(1.13)  LDD0684  [11]
 LDCM0368  CL10 HCT 116 C677(0.74); C49(0.74); C590(0.75); C417(0.78)  LDD0685  [11]
 LDCM0369  CL100 HCT 116 C417(0.46); C384(0.62); C678(0.70); C590(0.79)  LDD0686  [11]
 LDCM0370  CL101 HCT 116 C417(0.40); C677(0.62); C678(0.62); C590(0.72)  LDD0687  [11]
 LDCM0371  CL102 HCT 116 C417(0.69); C590(0.96); C677(0.97); C678(0.97)  LDD0688  [11]
 LDCM0372  CL103 HCT 116 C417(0.70); C677(1.07); C678(1.07); C590(1.40)  LDD0689  [11]
 LDCM0373  CL104 HCT 116 C417(0.74); C590(0.80); C677(0.86); C678(0.86)  LDD0690  [11]
 LDCM0374  CL105 HCT 116 C417(0.45); C590(1.00); C384(1.13); C49(1.18)  LDD0691  [11]
 LDCM0375  CL106 HCT 116 C417(0.28); C590(1.03); C49(1.24); C384(1.69)  LDD0692  [11]
 LDCM0376  CL107 HCT 116 C417(0.52); C590(1.04); C49(1.14); C384(1.29)  LDD0693  [11]
 LDCM0377  CL108 HCT 116 C417(0.50); C49(1.05); C590(1.15); C384(1.28)  LDD0694  [11]
 LDCM0378  CL109 HCT 116 C417(0.52); C590(0.89); C49(0.95); C384(0.99)  LDD0695  [11]
 LDCM0379  CL11 HCT 116 C49(0.61); C590(0.79); C677(0.81); C417(0.85)  LDD0696  [11]
 LDCM0380  CL110 HCT 116 C417(0.37); C49(0.96); C590(1.05); C384(1.25)  LDD0697  [11]
 LDCM0381  CL111 HCT 116 C417(0.61); C49(0.72); C384(0.81); C590(0.87)  LDD0698  [11]
 LDCM0382  CL112 HCT 116 C49(0.71); C417(0.90); C351(0.91); C590(1.06)  LDD0699  [11]
 LDCM0383  CL113 HCT 116 C49(0.44); C351(0.53); C590(0.65); C417(0.72)  LDD0700  [11]
 LDCM0384  CL114 HCT 116 C351(0.56); C49(0.69); C590(0.73); C417(0.81)  LDD0701  [11]
 LDCM0385  CL115 HCT 116 C351(0.55); C49(0.59); C417(0.78); C590(0.79)  LDD0702  [11]
 LDCM0386  CL116 HCT 116 C351(0.65); C590(0.74); C417(0.74); C49(0.98)  LDD0703  [11]
 LDCM0387  CL117 HCT 116 C590(0.68); C351(0.82); C417(0.86); C49(0.86)  LDD0704  [11]
 LDCM0388  CL118 HCT 116 C590(0.81); C351(0.83); C417(0.85); C49(1.07)  LDD0705  [11]
 LDCM0389  CL119 HCT 116 C351(0.68); C417(0.83); C590(0.87); C49(1.04)  LDD0706  [11]
 LDCM0390  CL12 HCT 116 C590(0.73); C417(0.88); C49(0.90); C677(0.94)  LDD0707  [11]
 LDCM0391  CL120 HCT 116 C351(0.57); C590(0.87); C49(0.87); C417(0.93)  LDD0708  [11]
 LDCM0392  CL121 HCT 116 C49(0.51); C384(0.75); C417(0.89); C590(1.27)  LDD0709  [11]
 LDCM0393  CL122 HCT 116 C49(0.55); C417(0.83); C590(0.84); C384(1.21)  LDD0710  [11]
 LDCM0394  CL123 HCT 116 C384(0.53); C49(0.57); C417(0.80); C590(0.82)  LDD0711  [11]
 LDCM0395  CL124 HCT 116 C49(0.51); C384(0.52); C590(0.79); C417(0.89)  LDD0712  [11]
 LDCM0396  CL125 HCT 116 C417(0.70); C590(0.78); C384(0.82); C351(0.99)  LDD0713  [11]
 LDCM0397  CL126 HCT 116 C417(0.60); C590(0.68); C384(0.74); C351(0.84)  LDD0714  [11]
 LDCM0398  CL127 HCT 116 C351(0.61); C417(0.69); C590(0.83); C49(1.04)  LDD0715  [11]
 LDCM0399  CL128 HCT 116 C417(0.54); C590(0.65); C351(0.68); C49(0.89)  LDD0716  [11]
 LDCM0400  CL13 HCT 116 C677(0.70); C590(0.74); C417(0.77); C49(0.89)  LDD0717  [11]
 LDCM0401  CL14 HCT 116 C49(0.94); C677(0.97); C417(0.99); C351(1.03)  LDD0718  [11]
 LDCM0402  CL15 HCT 116 C677(0.70); C417(0.78); C590(0.87); C384(0.91)  LDD0719  [11]
 LDCM0403  CL16 HCT 116 C351(0.68); C590(0.70); C384(0.83); C49(0.84)  LDD0720  [11]
 LDCM0404  CL17 HCT 116 C384(0.50); C590(0.79); C417(0.89); C49(1.03)  LDD0721  [11]
 LDCM0405  CL18 HCT 116 C590(0.74); C384(0.88); C417(0.95); C351(1.06)  LDD0722  [11]
 LDCM0406  CL19 HCT 116 C417(0.59); C590(0.73); C384(0.90); C351(1.02)  LDD0723  [11]
 LDCM0407  CL2 HCT 116 C384(0.96); C49(1.02); C677(1.02); C351(1.11)  LDD0724  [11]
 LDCM0408  CL20 HCT 116 C417(0.69); C590(0.72); C384(0.82); C351(0.88)  LDD0725  [11]
 LDCM0409  CL21 HCT 116 C590(0.53); C417(0.54); C384(0.89); C49(1.01)  LDD0726  [11]
 LDCM0410  CL22 HCT 116 C417(0.54); C590(0.59); C351(0.89); C49(1.02)  LDD0727  [11]
 LDCM0411  CL23 HCT 116 C417(0.71); C590(0.83); C351(0.89); C384(0.91)  LDD0728  [11]
 LDCM0412  CL24 HCT 116 C590(0.58); C417(0.63); C351(0.88); C49(0.95)  LDD0729  [11]
 LDCM0413  CL25 HCT 116 C351(0.84); C384(0.82); C417(0.65); C49(0.86)  LDD0730  [11]
 LDCM0414  CL26 HCT 116 C351(0.85); C384(0.88); C417(0.78); C49(0.88)  LDD0731  [11]
 LDCM0415  CL27 HCT 116 C351(0.99); C384(0.78); C417(0.60); C49(1.06)  LDD0732  [11]
 LDCM0416  CL28 HCT 116 C351(0.79); C384(0.77); C417(0.61); C49(0.99)  LDD0733  [11]
 LDCM0417  CL29 HCT 116 C351(1.03); C384(0.99); C417(0.60); C49(1.18)  LDD0734  [11]
 LDCM0418  CL3 HCT 116 C351(1.07); C384(0.81); C417(1.12); C49(0.98)  LDD0735  [11]
 LDCM0419  CL30 HCT 116 C351(1.16); C384(0.77); C417(0.73); C49(1.20)  LDD0736  [11]
 LDCM0420  CL31 HCT 116 C351(0.77); C384(0.84); C417(0.88); C49(1.28)  LDD0737  [11]
 LDCM0421  CL32 HCT 116 C351(0.64); C384(0.69); C417(0.94); C49(0.79)  LDD0738  [11]
 LDCM0422  CL33 HCT 116 C351(0.54); C384(0.79); C417(0.77); C49(1.03)  LDD0739  [11]
 LDCM0423  CL34 HCT 116 C351(0.59); C384(0.90); C417(0.61); C49(0.58)  LDD0740  [11]
 LDCM0424  CL35 HCT 116 C351(0.65); C384(0.81); C417(0.97); C49(0.69)  LDD0741  [11]
 LDCM0425  CL36 HCT 116 C351(0.70); C384(0.91); C417(0.76); C49(0.77)  LDD0742  [11]
 LDCM0426  CL37 HCT 116 C351(0.67); C384(0.74); C417(0.78); C49(0.72)  LDD0743  [11]
 LDCM0428  CL39 HCT 116 C351(0.70); C384(0.62); C417(0.85); C49(0.72)  LDD0745  [11]
 LDCM0429  CL4 HCT 116 C351(0.96); C384(0.86); C417(0.93); C49(0.90)  LDD0746  [11]
 LDCM0430  CL40 HCT 116 C351(0.67); C384(0.48); C417(0.84); C49(0.82)  LDD0747  [11]
 LDCM0431  CL41 HCT 116 C351(0.70); C384(0.46); C417(0.72); C49(0.77)  LDD0748  [11]
 LDCM0432  CL42 HCT 116 C351(0.65); C384(0.44); C417(0.80); C49(0.72)  LDD0749  [11]
 LDCM0433  CL43 HCT 116 C351(0.66); C384(0.48); C417(0.75); C49(0.69)  LDD0750  [11]
 LDCM0434  CL44 HCT 116 C351(0.69); C384(0.50); C417(0.67); C49(0.69)  LDD0751  [11]
 LDCM0435  CL45 HCT 116 C351(0.66); C384(0.49); C417(0.62); C49(0.62)  LDD0752  [11]
 LDCM0436  CL46 HCT 116 C351(0.67); C384(1.35); C417(1.96); C49(0.76)  LDD0753  [11]
 LDCM0437  CL47 HCT 116 C351(0.69); C384(0.81); C417(1.81); C49(0.82)  LDD0754  [11]
 LDCM0438  CL48 HCT 116 C351(0.89); C384(1.22); C417(2.12); C49(0.88)  LDD0755  [11]
 LDCM0439  CL49 HCT 116 C351(1.05); C384(0.78); C417(1.44); C49(0.97)  LDD0756  [11]
 LDCM0440  CL5 HCT 116 C351(1.10); C384(1.03); C417(1.00); C49(1.06)  LDD0757  [11]
 LDCM0441  CL50 HCT 116 C351(0.83); C384(0.82); C417(1.42); C49(1.01)  LDD0758  [11]
 LDCM0442  CL51 HCT 116 C351(0.83); C384(1.22); C417(1.52); C49(1.09)  LDD0759  [11]
 LDCM0443  CL52 HCT 116 C351(0.71); C384(0.99); C417(1.47); C49(0.86)  LDD0760  [11]
 LDCM0444  CL53 HCT 116 C351(0.60); C384(0.80); C417(1.66); C49(0.77)  LDD0761  [11]
 LDCM0445  CL54 HCT 116 C351(0.61); C384(0.87); C417(1.66); C49(0.89)  LDD0762  [11]
 LDCM0446  CL55 HCT 116 C351(0.72); C384(1.08); C417(1.95); C49(1.06)  LDD0763  [11]
 LDCM0447  CL56 HCT 116 C351(0.67); C384(0.96); C417(1.22); C49(0.94)  LDD0764  [11]
 LDCM0448  CL57 HCT 116 C351(0.74); C384(0.63); C417(1.31); C49(1.09)  LDD0765  [11]
 LDCM0449  CL58 HCT 116 C351(0.82); C384(0.85); C417(1.68); C49(1.09)  LDD0766  [11]
 LDCM0450  CL59 HCT 116 C351(0.73); C384(1.06); C417(1.23); C49(1.13)  LDD0767  [11]
 LDCM0451  CL6 HCT 116 C351(0.99); C384(0.98); C417(0.85); C49(0.85)  LDD0768  [11]
 LDCM0452  CL60 HCT 116 C351(0.77); C384(1.08); C417(1.37); C49(0.98)  LDD0769  [11]
 LDCM0453  CL61 HCT 116 C351(0.85); C384(1.03); C417(0.78); C49(1.12)  LDD0770  [11]
 LDCM0454  CL62 HCT 116 C351(0.73); C384(0.98); C417(0.77); C49(1.07)  LDD0771  [11]
 LDCM0455  CL63 HCT 116 C351(0.66); C384(0.88); C417(0.57); C49(1.05)  LDD0772  [11]
 LDCM0456  CL64 HCT 116 C351(0.66); C384(0.82); C417(0.47); C49(1.43)  LDD0773  [11]
 LDCM0457  CL65 HCT 116 C351(0.79); C384(0.93); C417(0.62); C49(1.24)  LDD0774  [11]
 LDCM0458  CL66 HCT 116 C351(0.73); C384(0.80); C417(0.46); C49(1.15)  LDD0775  [11]
 LDCM0459  CL67 HCT 116 C351(0.72); C384(0.87); C417(0.53); C49(1.20)  LDD0776  [11]
 LDCM0460  CL68 HCT 116 C351(0.49); C384(0.75); C417(0.47); C49(0.91)  LDD0777  [11]
 LDCM0461  CL69 HCT 116 C351(0.74); C384(0.79); C417(1.14); C49(1.04)  LDD0778  [11]
 LDCM0462  CL7 HCT 116 C351(1.02); C384(1.07); C417(0.88); C49(0.83)  LDD0779  [11]
 LDCM0463  CL70 HCT 116 C351(0.69); C384(0.85); C417(0.64); C49(1.17)  LDD0780  [11]
 LDCM0464  CL71 HCT 116 C351(0.62); C384(0.81); C417(0.51); C49(1.21)  LDD0781  [11]
 LDCM0465  CL72 HCT 116 C351(0.65); C384(1.06); C417(0.74); C49(1.07)  LDD0782  [11]
 LDCM0466  CL73 HCT 116 C351(0.58); C384(0.93); C417(0.65); C49(1.01)  LDD0783  [11]
 LDCM0467  CL74 HCT 116 C351(0.60); C384(0.77); C417(0.56); C49(1.26)  LDD0784  [11]
 LDCM0469  CL76 HCT 116 C351(1.37); C384(1.04); C417(0.68); C49(1.08)  LDD0786  [11]
 LDCM0470  CL77 HCT 116 C351(1.25); C384(0.90); C417(1.08); C49(0.98)  LDD0787  [11]
 LDCM0471  CL78 HCT 116 C351(1.01); C384(1.33); C417(0.58); C49(1.07)  LDD0788  [11]
 LDCM0472  CL79 HCT 116 C351(1.47); C384(0.92); C417(0.56); C49(0.97)  LDD0789  [11]
 LDCM0473  CL8 HCT 116 C351(0.89); C384(0.82); C417(0.87); C49(0.76)  LDD0790  [11]
 LDCM0474  CL80 HCT 116 C351(1.21); C384(1.47); C417(1.26); C49(1.10)  LDD0791  [11]
 LDCM0475  CL81 HCT 116 C351(1.89); C384(1.17); C417(0.57); C49(0.94)  LDD0792  [11]
 LDCM0476  CL82 HCT 116 C351(2.18); C384(1.10); C417(0.50); C49(1.28)  LDD0793  [11]
 LDCM0477  CL83 HCT 116 C351(1.64); C384(0.97); C417(0.51); C49(0.91)  LDD0794  [11]
 LDCM0478  CL84 HCT 116 C351(1.16); C384(1.10); C417(0.48); C49(0.91)  LDD0795  [11]
 LDCM0479  CL85 HCT 116 C351(1.14); C384(0.99); C417(0.62); C49(0.87)  LDD0796  [11]
 LDCM0480  CL86 HCT 116 C351(1.42); C384(1.11); C417(0.78); C49(0.90)  LDD0797  [11]
 LDCM0481  CL87 HCT 116 C351(2.35); C384(0.98); C417(0.54); C49(1.05)  LDD0798  [11]
 LDCM0482  CL88 HCT 116 C351(2.18); C384(1.11); C417(0.48); C49(0.94)  LDD0799  [11]
 LDCM0483  CL89 HCT 116 C351(1.30); C384(1.10); C417(0.43); C49(1.06)  LDD0800  [11]
 LDCM0484  CL9 HCT 116 C351(1.03); C384(1.46); C417(0.95); C49(0.74)  LDD0801  [11]
 LDCM0485  CL90 HCT 116 C351(1.71); C384(0.93); C417(0.94); C49(1.00)  LDD0802  [11]
 LDCM0486  CL91 HCT 116 C351(0.92); C384(0.83); C417(0.53); C49(1.03)  LDD0803  [11]
 LDCM0487  CL92 HCT 116 C351(0.94); C384(0.86); C417(0.57); C49(0.91)  LDD0804  [11]
 LDCM0488  CL93 HCT 116 C351(1.40); C384(0.65); C417(0.70); C49(1.22)  LDD0805  [11]
 LDCM0489  CL94 HCT 116 C351(1.37); C384(0.87); C417(0.40); C49(0.95)  LDD0806  [11]
 LDCM0490  CL95 HCT 116 C351(1.04); C384(0.90); C417(0.43); C49(0.88)  LDD0807  [11]
 LDCM0491  CL96 HCT 116 C351(0.96); C384(0.80); C417(0.47); C49(0.93)  LDD0808  [11]
 LDCM0492  CL97 HCT 116 C351(0.87); C384(0.78); C417(0.48); C49(0.86)  LDD0809  [11]
 LDCM0493  CL98 HCT 116 C351(1.00); C384(0.75); C417(0.46); C49(0.89)  LDD0810  [11]
 LDCM0494  CL99 HCT 116 C351(1.18); C384(0.73); C417(0.46); C49(0.83)  LDD0811  [11]
 LDCM0495  E2913 HEK-293T C384(1.00); C351(0.95); C250(1.09); C677(0.91)  LDD1698  [29]
 LDCM0213  Electrophilic fragment 2 MDA-MB-231 C49(1.22)  LDD1702  [9]
 LDCM0468  Fragment33 HCT 116 C351(0.64); C384(0.86); C417(0.51); C49(1.20)  LDD0785  [11]
 LDCM0427  Fragment51 HCT 116 C351(0.71); C384(0.82); C417(0.77); C49(0.74)  LDD0744  [11]
 LDCM0107  IAA HeLa C351(0.00); C384(0.00); C590(0.00)  LDD0221  [19]
 LDCM0179  JZ128 PC-3 N.A.  LDD0462  [8]
 LDCM0022  KB02 HEK-293T C384(0.83); C351(0.97); C677(0.96)  LDD1492  [29]
 LDCM0023  KB03 HEK-293T C384(0.94); C351(0.99); C677(1.02)  LDD1497  [29]
 LDCM0024  KB05 COLO792 C417(2.21); C590(2.71)  LDD3310  [30]
 LDCM0109  NEM HeLa N.A.  LDD0223  [19]
 LDCM0499  Nucleophilic fragment 12b MDA-MB-231 C49(0.79)  LDD2092  [9]
 LDCM0501  Nucleophilic fragment 13b MDA-MB-231 C49(1.11)  LDD2094  [9]
 LDCM0503  Nucleophilic fragment 14b MDA-MB-231 C590(0.10)  LDD2096  [9]
 LDCM0506  Nucleophilic fragment 16a MDA-MB-231 C590(1.46); C351(1.17)  LDD2099  [9]
 LDCM0511  Nucleophilic fragment 18b MDA-MB-231 C351(0.42)  LDD2104  [9]
 LDCM0513  Nucleophilic fragment 19b MDA-MB-231 C351(0.46)  LDD2106  [9]
 LDCM0514  Nucleophilic fragment 20a MDA-MB-231 C590(1.04); C351(1.07)  LDD2107  [9]
 LDCM0515  Nucleophilic fragment 20b MDA-MB-231 C351(0.51)  LDD2108  [9]
 LDCM0516  Nucleophilic fragment 21a MDA-MB-231 C590(0.65); C351(0.73)  LDD2109  [9]
 LDCM0517  Nucleophilic fragment 21b MDA-MB-231 C351(0.26)  LDD2110  [9]
 LDCM0518  Nucleophilic fragment 22a MDA-MB-231 C590(1.45); C49(0.77)  LDD2111  [9]
 LDCM0521  Nucleophilic fragment 23b MDA-MB-231 C351(0.33)  LDD2114  [9]
 LDCM0525  Nucleophilic fragment 25b MDA-MB-231 C590(0.36)  LDD2118  [9]
 LDCM0526  Nucleophilic fragment 26a MDA-MB-231 C49(1.19)  LDD2119  [9]
 LDCM0529  Nucleophilic fragment 27b MDA-MB-231 C49(0.44)  LDD2122  [9]
 LDCM0530  Nucleophilic fragment 28a MDA-MB-231 C590(1.17); C351(1.07)  LDD2123  [9]
 LDCM0531  Nucleophilic fragment 28b MDA-MB-231 C49(0.44)  LDD2124  [9]
 LDCM0532  Nucleophilic fragment 29a MDA-MB-231 C590(1.06); C351(0.98)  LDD2125  [9]
 LDCM0533  Nucleophilic fragment 29b MDA-MB-231 C590(0.15); C49(0.43)  LDD2126  [9]
 LDCM0536  Nucleophilic fragment 31 MDA-MB-231 C590(1.59); C351(1.45)  LDD2129  [9]
 LDCM0542  Nucleophilic fragment 37 MDA-MB-231 C590(2.17); C351(1.49)  LDD2135  [9]
 LDCM0543  Nucleophilic fragment 38 MDA-MB-231 C351(1.14)  LDD2136  [9]
 LDCM0544  Nucleophilic fragment 39 MDA-MB-231 C351(0.88)  LDD2137  [9]
 LDCM0546  Nucleophilic fragment 40 MDA-MB-231 C590(1.18)  LDD2140  [9]
 LDCM0549  Nucleophilic fragment 43 MDA-MB-231 C49(0.60)  LDD2143  [9]
 LDCM0550  Nucleophilic fragment 5a MDA-MB-231 C590(1.48)  LDD2144  [9]
 LDCM0552  Nucleophilic fragment 6a MDA-MB-231 C590(0.97); C351(1.03)  LDD2146  [9]
 LDCM0556  Nucleophilic fragment 8a MDA-MB-231 C351(0.76)  LDD2150  [9]
 LDCM0021  THZ1 HCT 116 C590(0.99); C351(1.00); C384(1.08); C417(1.13)  LDD2173  [11]

The Interaction Atlas With This Target

The Protein(s) Related To This Target

Enzyme
Click To Hide/Show 2 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Cystic fibrosis transmembrane conductance regulator (CFTR) ABCC family P13569
Tyrosine-protein phosphatase non-receptor type 1 (PTPN1) Protein-tyrosine phosphatase family P18031
Transporter and channel
Click To Hide/Show 2 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Amyloid-beta precursor protein (APP) APP family P05067
Optineurin (OPTN) . Q96CV9
Transcription factor
Click To Hide/Show 1 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Signal transducer and activator of transcription 3 (STAT3) Transcription factor STAT family P40763
Other
Click To Hide/Show 2 Protein(s) Interacting with This Target
Protein name Family Uniprot ID
Bcl2-associated agonist of cell death (BAD) Bcl-2 family Q92934
Ezrin (EZR) . P15311

The Drug(s) Related To This Target

Investigative
Click To Hide/Show 3 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
(2s)-4-methyl-2-(3-phenylthioureido)-n-((3s)-tetrahydro-2-hydroxy-3-furanyl)Pentanamide . DB07627
4-[[(2s)-2-[[(2s)-3-carboxy-2-hydroxypropanoyl]Amino]-4-methylpentanoyl]Amino]Butyl-(Diaminomethylidene)Azanium . DB04276
N-[(Benzyloxy)Carbonyl]-l-leucyl-n-[(1s)-3-fluoro-1-(4-hydroxybenzyl)-2-oxopropyl]-l-leucinamide . DB04653
Patented
Click To Hide/Show 1 Drug(s) Interacting with This Target
Drug Name Drug Type External ID
Undecylenic Acid Derivative 1 Small molecular drug D08VAT

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 2-Ethynylbenzaldehyde-Based, Lysine-Targeting Irreversible Covalent Inhibitors for Protein Kinases and Nonkinases. J Am Chem Soc. 2023 Feb 12. doi: 10.1021/jacs.2c11595. Online ahead of print.
Mass spectrometry data entry: PXD037665
3 2H-Azirine-Based Reagents for Chemoselective Bioconjugation at Carboxyl Residues Inside Live Cells. J Am Chem Soc. 2020 Apr 1;142(13):6051-6059. doi: 10.1021/jacs.9b12116. Epub 2020 Mar 23.
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 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.
6 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
7 An Azo Coupling-Based Chemoproteomic Approach to Systematically Profile the Tyrosine Reactivity in the Human Proteome. Anal Chem. 2021 Jul 27;93(29):10334-10342. doi: 10.1021/acs.analchem.1c01935. Epub 2021 Jul 12.
8 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.
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 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
11 Reimagining high-throughput profiling of reactive cysteines for cell-based screening of large electrophile libraries. Nat Biotechnol. 2021 May;39(5):630-641. doi: 10.1038/s41587-020-00778-3. Epub 2021 Jan 4.
12 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.
13 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
14 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
15 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
16 A modification-centric assessment tool for the performance of chemoproteomic probes. Nat Chem Biol. 2022 Aug;18(8):904-912. doi: 10.1038/s41589-022-01074-8. Epub 2022 Jul 21.
Mass spectrometry data entry: PXD027758 , PXD027755 , PXD027760 , PXD027762 , PXD027756 , PXD027591 , PXD007149 , PXD030064 , PXD032392 , PXD027789 , PXD027767 , PXD027764
17 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
18 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
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 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.
22 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
23 Global targeting of functional tyrosines using sulfur-triazole exchange chemistry. Nat Chem Biol. 2020 Feb;16(2):150-159. doi: 10.1038/s41589-019-0404-5. Epub 2019 Nov 25.
24 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
25 Ligand and Target Discovery by Fragment-Based Screening in Human Cells. Cell. 2017 Jan 26;168(3):527-541.e29. doi: 10.1016/j.cell.2016.12.029. Epub 2017 Jan 19.
26 Design and synthesis of minimalist terminal alkyne-containing diazirine photo-crosslinkers and their incorporation into kinase inhibitors for cell- and tissue-based proteome profiling. Angew Chem Int Ed Engl. 2013 Aug 12;52(33):8551-6. doi: 10.1002/anie.201300683. Epub 2013 Jun 10.
27 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.
28 Covalent Ligand Screening Uncovers a RNF4 E3 Ligase Recruiter for Targeted Protein Degradation Applications. ACS Chem Biol. 2019 Nov 15;14(11):2430-2440. doi: 10.1021/acschembio.8b01083. Epub 2019 May 13.
29 Accelerating multiplexed profiling of protein-ligand interactions: High-throughput plate-based reactive cysteine profiling with minimal input. Cell Chem Biol. 2024 Mar 21;31(3):565-576.e4. doi: 10.1016/j.chembiol.2023.11.015. Epub 2023 Dec 19.
Mass spectrometry data entry: PXD044402
30 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