BDBM50110379 4-{3-[(S)-3-(2,3-Dihydro-benzofuran-5-sulfonylamino)-2-oxo-2,3,4,5-tetrahydro-benzo[b]azepin-1-yl]-2-oxo-propyl}-benzamidine::CHEMBL351256

SMILES: NC(=N)c1ccc(CC(=O)CN2c3ccccc3CC[C@H](NS(=O)(=O)c3ccc4OCCc4c3)C2=O)cc1

InChI Key: InChIKey=CDRQZRZODAGYKU-DEOSSOPVSA-N

Data: 3 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 3 hits for monomerid = 50110379   

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))	BDBM50110379 (4-{3-[(S)-3-(2,3-Dihydro-benzofuran-5-sulfonylamin...) Show SMILES NC(=N)c1ccc(CC(=O)CN2c3ccccc3CC[C@H](NS(=O)(=O)c3ccc4OCCc4c3)C2=O)cc1 Show InChI InChI=1S/C28H28N4O5S/c29-27(30)20-7-5-18(6-8-20)15-22(33)17-32-25-4-2-1-3-19(25)9-11-24(28(32)34)31-38(35,36)23-10-12-26-21(16-23)13-14-37-26/h1-8,10,12,16,24,31H,9,11,13-15,17H2,(H3,29,30)/t24-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	14	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
Serine protease 1/Trypsin-2/Trypsin-3 (Homo sapiens (Human))	BDBM50110379 (4-{3-[(S)-3-(2,3-Dihydro-benzofuran-5-sulfonylamin...) Show SMILES NC(=N)c1ccc(CC(=O)CN2c3ccccc3CC[C@H](NS(=O)(=O)c3ccc4OCCc4c3)C2=O)cc1 Show InChI InChI=1S/C28H28N4O5S/c29-27(30)20-7-5-18(6-8-20)15-22(33)17-32-25-4-2-1-3-19(25)9-11-24(28(32)34)31-38(35,36)23-10-12-26-21(16-23)13-14-37-26/h1-8,10,12,16,24,31H,9,11,13-15,17H2,(H3,29,30)/t24-/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	20	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
Coagulation factor X (Homo sapiens (Human))	BDBM50110379 (4-{3-[(S)-3-(2,3-Dihydro-benzofuran-5-sulfonylamin...) Show SMILES NC(=N)c1ccc(CC(=O)CN2c3ccccc3CC[C@H](NS(=O)(=O)c3ccc4OCCc4c3)C2=O)cc1 Show InChI InChI=1S/C28H28N4O5S/c29-27(30)20-7-5-18(6-8-20)15-22(33)17-32-25-4-2-1-3-19(25)9-11-24(28(32)34)31-38(35,36)23-10-12-26-21(16-23)13-14-37-26/h1-8,10,12,16,24,31H,9,11,13-15,17H2,(H3,29,30)/t24-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>338	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 Coagulation factor Xa determined in Vitro				Bioorg Med Chem Lett 12: 743-8 (2002) BindingDB Entry DOI: 10.7270/Q25B0319
					More data for this Ligand-Target Pair