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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 = 'BDBM50079229'   
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))
BDBM50079229
PNG
(3-(3-Carbamimidoyl-phenyl)-5-methyl-4,5-dihydro-is...)
Show SMILES CC1(CC(=NO1)c1cccc(c1)C(N)=N)C(=O)Nc1ccc(cn1)-c1ccccc1S(N)(=O)=O |c:3|
Show InChI InChI=1S/C23H22N6O4S/c1-23(12-18(29-33-23)14-5-4-6-15(11-14)21(24)25)22(30)28-20-10-9-16(13-27-20)17-7-2-3-8-19(17)34(26,31)32/h2-11,13H,12H2,1H3,(H3,24,25)(H2,26,31,32)(H,27,28,30)
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Similars

Article
PubMed
4.10n/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