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BDBM50113602 (E)-3-(3-Carbamimidoyl-phenyl)-N-(2'-sulfamoyl-biphenyl-4-yl)-acrylamide::CHEMBL290382

SMILES: NC(=N)c1cccc(\C=C/C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c1

InChI Key: InChIKey=JKDFPVVULZXZIM-JYRVWZFOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50113602   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50113602
PNG
((E)-3-(3-Carbamimidoyl-phenyl)-N-(2'-sulfamoyl-bip...)
Show SMILES NC(=N)c1cccc(\C=C/C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c1
Show InChI InChI=1S/C22H20N4O3S/c23-22(24)17-5-3-4-15(14-17)8-13-21(27)26-18-11-9-16(10-12-18)19-6-1-2-7-20(19)30(25,28)29/h1-14H,(H3,23,24)(H,26,27)(H2,25,28,29)/b13-8-
PDB
MMDB

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PubMed
n/an/a 17n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity against factor Xa


Bioorg Med Chem Lett 12: 1511-5 (2002)


BindingDB Entry DOI: 10.7270/Q2P84B6X
More data for this
Ligand-Target Pair