BDBM50110378 CHEMBL350262::N-{(S)-1-[3-(6-Amino-2-methyl-pyridin-3-yl)-2-oxo-propyl]-2-oxo-azepan-3-yl}-C-phenyl-methanesulfonamide

SMILES: Cc1nc(N)ccc1CC(=O)CN1CCCC[C@H](NS(=O)(=O)Cc2ccccc2)C1=O

InChI Key: InChIKey=OCCWKTJASUENNR-FQEVSTJZSA-N

Data: 2 KI

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 = 50110378   

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))	BDBM50110378 (CHEMBL350262 | N-{(S)-1-[3-(6-Amino-2-methyl-pyrid...) Show SMILES Cc1nc(N)ccc1CC(=O)CN1CCCC[C@H](NS(=O)(=O)Cc2ccccc2)C1=O Show InChI InChI=1S/C22H28N4O4S/c1-16-18(10-11-21(23)24-16)13-19(27)14-26-12-6-5-9-20(22(26)28)25-31(29,30)15-17-7-3-2-4-8-17/h2-4,7-8,10-11,20,25H,5-6,9,12-15H2,1H3,(H2,23,24)/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	93	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description Inhibitory constant against human thrombin (FIIa) determined in vitro				Bioorg Med Chem Lett 12: 743-8 (2002) BindingDB Entry DOI: 10.7270/Q25B0319
					More data for this Ligand-Target Pair
Trypsin (Homo sapiens (Human))	BDBM50110378 (CHEMBL350262 | N-{(S)-1-[3-(6-Amino-2-methyl-pyrid...) Show SMILES Cc1nc(N)ccc1CC(=O)CN1CCCC[C@H](NS(=O)(=O)Cc2ccccc2)C1=O Show InChI InChI=1S/C22H28N4O4S/c1-16-18(10-11-21(23)24-16)13-19(27)14-26-12-6-5-9-20(22(26)28)25-31(29,30)15-17-7-3-2-4-8-17/h2-4,7-8,10-11,20,25H,5-6,9,12-15H2,1H3,(H2,23,24)/t20-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.68E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Corvas International, Inc. Curated by ChEMBL					Assay Description Inhibitory constant against trypsin determined in Vitro				Bioorg Med Chem Lett 12: 743-8 (2002) BindingDB Entry DOI: 10.7270/Q25B0319
					More data for this Ligand-Target Pair