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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 = 'BDBM50112492'   
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))
BDBM50112492
PNG
(CHEMBL26287 | N-[3-(3-Carbamimidoyl-phenyl)-allyl]...)
Show SMILES CCOC(=O)CCC(=O)N(C\C=C\c1cccc(c1)C(N)=N)c1ccc(OC2CCN(CC2)C(C)=N)c(c1)C(F)(F)F
Show InChI InChI=1S/C30H36F3N5O4/c1-3-41-28(40)12-11-27(39)38(15-5-7-21-6-4-8-22(18-21)29(35)36)23-9-10-26(25(19-23)30(31,32)33)42-24-13-16-37(17-14-24)20(2)34/h4-10,18-19,24,34H,3,11-17H2,1-2H3,(H3,35,36)/b7-5+,34-20?
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MMDB

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PubMed
0.550n/an/an/an/an/an/an/an/a



Berlex Biosciences

Curated by ChEMBL


Assay Description
Competitive inhibition of coagulation factor Xa


Bioorg Med Chem Lett 12: 1307-10 (2002)


BindingDB Entry DOI: 10.7270/Q21R6PV8
More data for this
Ligand-Target Pair