BDBM50082178 3-[3-Azepan-1-yl-2-(naphthalene-2-sulfonylamino)-3-oxo-propyl]-benzamidine::CHEMBL107592

SMILES: NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCCCCC2)c1

InChI Key: InChIKey=VIQGIWIWABCQHU-UHFFFAOYSA-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 = 50082178   

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
Trypsin II (Bos taurus)	BDBM50082178 (3-[3-Azepan-1-yl-2-(naphthalene-2-sulfonylamino)-3...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCCCCC2)c1 Show InChI InChI=1S/C26H30N4O3S/c27-25(28)22-11-7-8-19(16-22)17-24(26(31)30-14-5-1-2-6-15-30)29-34(32,33)23-13-12-20-9-3-4-10-21(20)18-23/h3-4,7-13,16,18,24,29H,1-2,5-6,14-15,17H2,(H3,27,28)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	740	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universität Jena Curated by ChEMBL					Assay Description Tested for inhibition of trypsin				Bioorg Med Chem Lett 9: 3147-52 (1999) BindingDB Entry DOI: 10.7270/Q2RB73S3
					More data for this Ligand-Target Pair
Plasminogen (Homo sapiens (Human))	BDBM50082178 (3-[3-Azepan-1-yl-2-(naphthalene-2-sulfonylamino)-3...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCCCCC2)c1 Show InChI InChI=1S/C26H30N4O3S/c27-25(28)22-11-7-8-19(16-22)17-24(26(31)30-14-5-1-2-6-15-30)29-34(32,33)23-13-12-20-9-3-4-10-21(20)18-23/h3-4,7-13,16,18,24,29H,1-2,5-6,14-15,17H2,(H3,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universität Jena Curated by ChEMBL					Assay Description Tested for inhibition of plasmin				Bioorg Med Chem Lett 9: 3147-52 (1999) BindingDB Entry DOI: 10.7270/Q2RB73S3
					More data for this Ligand-Target Pair
Urokinase-type plasminogen activator (Homo sapiens (Human))	BDBM50082178 (3-[3-Azepan-1-yl-2-(naphthalene-2-sulfonylamino)-3...) Show SMILES NC(=N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)N2CCCCCC2)c1 Show InChI InChI=1S/C26H30N4O3S/c27-25(28)22-11-7-8-19(16-22)17-24(26(31)30-14-5-1-2-6-15-30)29-34(32,33)23-13-12-20-9-3-4-10-21(20)18-23/h3-4,7-13,16,18,24,29H,1-2,5-6,14-15,17H2,(H3,27,28)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universität Jena Curated by ChEMBL					Assay Description Tested for inhibition of plasminogen activator urokinase (microPa)				Bioorg Med Chem Lett 9: 3147-52 (1999) BindingDB Entry DOI: 10.7270/Q2RB73S3
					More data for this Ligand-Target Pair