BDBM50107456 (S)-1-[(S)-2-(Naphthalene-2-sulfonylamino)-3-phenyl-propionyl]-pyrrolidine-2-carboxylic acid (4-guanidino-butyl)-amide::CHEMBL144529

SMILES: NC(=N)NCCCCNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1

InChI Key: InChIKey=ATZXVDFURGHGDC-UIOOFZCWSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50107456   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Prothrombin (Homo sapiens (Human))	BDBM50107456 ((S)-1-[(S)-2-(Naphthalene-2-sulfonylamino)-3-pheny...) Show SMILES NC(=N)NCCCCNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1ccccc1)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C29H36N6O4S/c30-29(31)33-17-7-6-16-32-27(36)26-13-8-18-35(26)28(37)25(19-21-9-2-1-3-10-21)34-40(38,39)24-15-14-22-11-4-5-12-23(22)20-24/h1-5,9-12,14-15,20,25-26,34H,6-8,13,16-19H2,(H,32,36)(H4,30,31,33)/t25-,26-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description In vitro inhibitory activity against hydrolysis of human alpha thrombin				Bioorg Med Chem Lett 12: 45-9 (2001) BindingDB Entry DOI: 10.7270/Q2GX4C3P
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