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BDBM50046348 1-(4-Oxo-4-pyridin-3-yl-butyryl)-pyrrolidine-2-carboxylic acid (1-formyl-4-guanidino-butyl)-amide::CHEMBL419168

SMILES: NC(=N)NCCCC(NC(=O)C1CCON1C(=O)C(=O)CCc1cccnc1)C=O

InChI Key: InChIKey=YZBFIPZLKZKKDL-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50046348   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Prothrombin


(Homo sapiens (Human))		BDBM50046348
PNG
(1-(4-Oxo-4-pyridin-3-yl-butyryl)-pyrrolidine-2-car...)
Show SMILES NC(=N)NCCCC(NC(=O)C1CCON1C(=O)C(=O)CCc1cccnc1)C=O
Show InChI InChI=1S/C19H26N6O5/c20-19(21)23-9-2-4-14(12-26)24-17(28)15-7-10-30-25(15)18(29)16(27)6-5-13-3-1-8-22-11-13/h1,3,8,11-12,14-15H,2,4-7,9-10H2,(H,24,28)(H4,20,21,23)
PDB

UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
PubMed
n/an/an/an/a 1.17E+3n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Concentration required to inhibit thrombin hydrolysis of the chromogenic substrate

J Med Chem 36: 300-3 (1993)


BindingDB Entry DOI: 10.7270/Q2JM28Q8
More data for this
Ligand-Target Pair