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Compile Data Set for Download or QSAR

Found 1 hit of ki for monomerid = 50117692   
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
Prothrombin


(Homo sapiens (Human))		BDBM50117692
PNG
(CHEMBL3613791)
Show SMILES NC(=N)c1ccc(cc1)C1C2C(C3CCCN13)C(=O)N(Cc1ccccc1)C2=O
Show InChI InChI=1S/C23H24N4O2/c24-21(25)16-10-8-15(9-11-16)20-19-18(17-7-4-12-26(17)20)22(28)27(23(19)29)13-14-5-2-1-3-6-14/h1-3,5-6,8-11,17-20H,4,7,12-13H2,(H3,24,25)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
 310n/an/an/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of thrombin (unknown origin)

J Med Chem 58: 7465-74 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00975
BindingDB Entry DOI: 10.7270/Q25H7J2H
More data for this
Ligand-Target Pair