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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vitamin K-dependent protein C' and Ligand = 'BDBM50193223'   
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
Vitamin K-dependent protein C


(Homo sapiens (Human))
BDBM50193223
PNG
(CHEMBL212786 | {(R)-1-[(S)-1-(4-carbamimidoyl-benz...)
Show SMILES CC(C)[C@@H](NCC(O)=O)C(=O)N[C@@H](C(c1ccccc1)c1ccccc1)C(=O)NCc1ccc(cc1)C(N)=N
Show InChI InChI=1S/C30H35N5O4/c1-19(2)26(33-18-24(36)37)30(39)35-27(29(38)34-17-20-13-15-23(16-14-20)28(31)32)25(21-9-5-3-6-10-21)22-11-7-4-8-12-22/h3-16,19,25-27,33H,17-18H2,1-2H3,(H3,31,32)(H,34,38)(H,35,39)(H,36,37)/t26-,27+/m1/s1
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a>3.30E+4n/an/an/an/an/an/a



Institut de Recherches Servier

Curated by ChEMBL


Assay Description
Inhibition of human aPC


J Med Chem 49: 5047-50 (2006)


Article DOI: 10.1021/jm0606950
BindingDB Entry DOI: 10.7270/Q2H994VN
More data for this
Ligand-Target Pair