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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 = 'BDBM50024356'   
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))
BDBM50024356
PNG
(CHEMBL3330442)
Show SMILES [H][C@@]12COc3cc(ccc3N1C(=O)O[C@H]2CNC(=O)c1ccc(Cl)s1)N1CCOCC1=O |r|
Show InChI InChI=1/C20H18ClN3O6S/c21-17-4-3-16(31-17)19(26)22-8-15-13-9-29-14-7-11(23-5-6-28-10-18(23)25)1-2-12(14)24(13)20(27)30-15/h1-4,7,13,15H,5-6,8-10H2,(H,22,26)/t13-,15-/s2
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.40n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human factor 10a using N-Z-D-Arg-Gly-Arg-pNA, S-2765 chromogenic substrate


J Med Chem 57: 7770-91 (2014)


Article DOI: 10.1021/jm501045e
BindingDB Entry DOI: 10.7270/Q228095Z
More data for this
Ligand-Target Pair