BDBM50081508 3-[(S)-3-(2-Ethoxy-quinoline-6-sulfonylamino)-2-oxo-pyrrolidin-1-ylmethyl]-benzamidine::CHEMBL327560

SMILES: CCOc1ccc2cc(ccc2n1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O

InChI Key: InChIKey=SFQMAWFBVWSKSI-FQEVSTJZSA-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 = 50081508   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50081508 (3-[(S)-3-(2-Ethoxy-quinoline-6-sulfonylamino)-2-ox...) Show SMILES CCOc1ccc2cc(ccc2n1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O Show InChI InChI=1S/C23H25N5O4S/c1-2-32-21-9-6-16-13-18(7-8-19(16)26-21)33(30,31)27-20-10-11-28(23(20)29)14-15-4-3-5-17(12-15)22(24)25/h3-9,12-13,20,27H,2,10-11,14H2,1H3,(H3,24,25)/t20-/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	>1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Binding affinity against serine protease factor Xa (fXa)				Bioorg Med Chem Lett 9: 2753-8 (1999) BindingDB Entry DOI: 10.7270/Q2W66K02
					More data for this Ligand-Target Pair
Trypsin-1 (Homo sapiens (Human))	BDBM50081508 (3-[(S)-3-(2-Ethoxy-quinoline-6-sulfonylamino)-2-ox...) Show SMILES CCOc1ccc2cc(ccc2n1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O Show InChI InChI=1S/C23H25N5O4S/c1-2-32-21-9-6-16-13-18(7-8-19(16)26-21)33(30,31)27-20-10-11-28(23(20)29)14-15-4-3-5-17(12-15)22(24)25/h3-9,12-13,20,27H,2,10-11,14H2,1H3,(H3,24,25)/t20-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Binding affinity against trypsin				Bioorg Med Chem Lett 9: 2753-8 (1999) BindingDB Entry DOI: 10.7270/Q2W66K02
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50081508 (3-[(S)-3-(2-Ethoxy-quinoline-6-sulfonylamino)-2-ox...) Show SMILES CCOc1ccc2cc(ccc2n1)S(=O)(=O)N[C@H]1CCN(Cc2cccc(c2)C(N)=N)C1=O Show InChI InChI=1S/C23H25N5O4S/c1-2-32-21-9-6-16-13-18(7-8-19(16)26-21)33(30,31)27-20-10-11-28(23(20)29)14-15-4-3-5-17(12-15)22(24)25/h3-9,12-13,20,27H,2,10-11,14H2,1H3,(H3,24,25)/t20-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Rhône-Poulenc Rorer Curated by ChEMBL					Assay Description Binding affinity against thrombin				Bioorg Med Chem Lett 9: 2753-8 (1999) BindingDB Entry DOI: 10.7270/Q2W66K02
					More data for this Ligand-Target Pair