BDBM50129976 4-{4-Methyl-3-oxo-7-[1-(pyrrolidine-1-carbonyl)-cyclopropyl]-3,4-dihydro-quinoxalin-2-ylmethyl}-benzamidine::CHEMBL431577

SMILES: Cn1c2ccc(cc2nc(Cc2ccc(cc2)C(N)=N)c1=O)C1(CC1)C(=O)N1CCCC1

InChI Key: InChIKey=UEHUUGPRNMGESG-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50129976   

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
Plasminogen (Homo sapiens (Human))	BDBM50129976 (4-{4-Methyl-3-oxo-7-[1-(pyrrolidine-1-carbonyl)-cy...) Show SMILES Cn1c2ccc(cc2nc(Cc2ccc(cc2)C(N)=N)c1=O)C1(CC1)C(=O)N1CCCC1 Show InChI InChI=1S/C25H27N5O2/c1-29-21-9-8-18(25(10-11-25)24(32)30-12-2-3-13-30)15-19(21)28-20(23(29)31)14-16-4-6-17(7-5-16)22(26)27/h4-9,15H,2-3,10-14H2,1H3,(H3,26,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	6.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma KG Curated by ChEMBL					Assay Description Inhibition of plasmin				Bioorg Med Chem Lett 13: 2297-302 (2003) BindingDB Entry DOI: 10.7270/Q2KS6QXW
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50129976 (4-{4-Methyl-3-oxo-7-[1-(pyrrolidine-1-carbonyl)-cy...) Show SMILES Cn1c2ccc(cc2nc(Cc2ccc(cc2)C(N)=N)c1=O)C1(CC1)C(=O)N1CCCC1 Show InChI InChI=1S/C25H27N5O2/c1-29-21-9-8-18(25(10-11-25)24(32)30-12-2-3-13-30)15-19(21)28-20(23(29)31)14-16-4-6-17(7-5-16)22(26)27/h4-9,15H,2-3,10-14H2,1H3,(H3,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-Aventis R&D Curated by ChEMBL					Assay Description Inhibition of factor-10a (unknown origin)				J Med Chem 56: 9441-56 (2014) Article DOI: 10.1021/jm4005835 BindingDB Entry DOI: 10.7270/Q20K2B0C
					More data for this Ligand-Target Pair
Coagulation factor X (Homo sapiens (Human))	BDBM50129976 (4-{4-Methyl-3-oxo-7-[1-(pyrrolidine-1-carbonyl)-cy...) Show SMILES Cn1c2ccc(cc2nc(Cc2ccc(cc2)C(N)=N)c1=O)C1(CC1)C(=O)N1CCCC1 Show InChI InChI=1S/C25H27N5O2/c1-29-21-9-8-18(25(10-11-25)24(32)30-12-2-3-13-30)15-19(21)28-20(23(29)31)14-16-4-6-17(7-5-16)22(26)27/h4-9,15H,2-3,10-14H2,1H3,(H3,26,27)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	84	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma KG Curated by ChEMBL					Assay Description Inhibition of coagulation factor X				Bioorg Med Chem Lett 13: 2297-302 (2003) BindingDB Entry DOI: 10.7270/Q2KS6QXW
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50129976 (4-{4-Methyl-3-oxo-7-[1-(pyrrolidine-1-carbonyl)-cy...) Show SMILES Cn1c2ccc(cc2nc(Cc2ccc(cc2)C(N)=N)c1=O)C1(CC1)C(=O)N1CCCC1 Show InChI InChI=1S/C25H27N5O2/c1-29-21-9-8-18(25(10-11-25)24(32)30-12-2-3-13-30)15-19(21)28-20(23(29)31)14-16-4-6-17(7-5-16)22(26)27/h4-9,15H,2-3,10-14H2,1H3,(H3,26,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharma KG Curated by ChEMBL					Assay Description Inhibition of human thrombin				Bioorg Med Chem Lett 13: 2297-302 (2003) BindingDB Entry DOI: 10.7270/Q2KS6QXW
					More data for this Ligand-Target Pair