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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50079241'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50079241
PNG
(5-Benzyl-3-(3-carbamimidoyl-phenyl)-4,5-dihydro-is...)
Show SMILES NC(=N)c1cccc(c1)C1=NOC(Cc2ccccc2)(C1)C(=O)Nc1ccc(cc1)-c1ccccc1S(N)(=O)=O |t:10|
Show InChI InChI=1S/C30H27N5O4S/c31-28(32)23-10-6-9-22(17-23)26-19-30(39-35-26,18-20-7-2-1-3-8-20)29(36)34-24-15-13-21(14-16-24)25-11-4-5-12-27(25)40(33,37)38/h1-17H,18-19H2,(H3,31,32)(H,34,36)(H2,33,37,38)
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8.5n/an/an/an/an/an/an/an/a



DuPont Pharmaceuticals Company

Curated by ChEMBL


Assay Description
Binding affinity towards human purified Coagulation factor Xa (FXa)


J Med Chem 42: 2760-73 (1999)


Article DOI: 10.1021/jm980406a
BindingDB Entry DOI: 10.7270/Q28W3CHG
More data for this
Ligand-Target Pair