BDBM50107438 (S)-1-[(S)-3-Hydroxy-2-(naphthalene-2-sulfonylamino)-propionyl]-pyrrolidine-2-carboxylic acid (4-guanidino-butyl)-amide::BMS-185367::CHEMBL136082

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

InChI Key: InChIKey=MHSALEQAXYJWDB-PMACEKPBSA-N

Data: 2 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 2 hits for monomerid = 50107438   

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))	BDBM50107438 ((S)-1-[(S)-3-Hydroxy-2-(naphthalene-2-sulfonylamin...) Show SMILES NC(=N)NCCCCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C23H32N6O5S/c24-23(25)27-12-4-3-11-26-21(31)20-8-5-13-29(20)22(32)19(15-30)28-35(33,34)18-10-9-16-6-1-2-7-17(16)14-18/h1-2,6-7,9-10,14,19-20,28,30H,3-5,8,11-13,15H2,(H,26,31)(H4,24,25,27)/t19-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.80E+3	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
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50107438 ((S)-1-[(S)-3-Hydroxy-2-(naphthalene-2-sulfonylamin...) Show SMILES NC(=N)NCCCCNC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NS(=O)(=O)c1ccc2ccccc2c1 Show InChI InChI=1S/C23H32N6O5S/c24-23(25)27-12-4-3-11-26-21(31)20-8-5-13-29(20)22(32)19(15-30)28-35(33,34)18-10-9-16-6-1-2-7-17(16)14-18/h1-2,6-7,9-10,14,19-20,28,30H,3-5,8,11-13,15H2,(H,26,31)(H4,24,25,27)/t19-,20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.80E+3	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 inhibition of human thrombin catalytic activity after 3 min pre incubation.				Bioorg Med Chem Lett 12: 41-4 (2001) BindingDB Entry DOI: 10.7270/Q2MP53T0
					More data for this Ligand-Target Pair