BDBM50215421 2-[6-(3-aminophenyl)-5-chloro-3-(cyclobutylamino)-2-oxo-1,2-dihydropyrazin-1-yl]-N-[(4-carbamimidoyl-3-hydroxyphenyl)methyl]acetamide::CHEMBL230031

SMILES: NC(=N)c1ccc(CNC(=O)Cn2c(c(Cl)nc(NC3CCC3)c2=O)-c2cccc(N)c2)cc1O

InChI Key: InChIKey=UZLBISOFSAIAQU-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50215421   

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))	BDBM50215421 (2-[6-(3-aminophenyl)-5-chloro-3-(cyclobutylamino)-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cn2c(c(Cl)nc(NC3CCC3)c2=O)-c2cccc(N)c2)cc1O Show InChI InChI=1S/C24H26ClN7O3/c25-21-20(14-3-1-4-15(26)10-14)32(24(35)23(31-21)30-16-5-2-6-16)12-19(34)29-11-13-7-8-17(22(27)28)18(33)9-13/h1,3-4,7-10,16,33H,2,5-6,11-12,26H2,(H3,27,28)(H,29,34)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of factor 10a				Bioorg Med Chem Lett 17: 4568-74 (2007) Article DOI: 10.1016/j.bmcl.2007.05.090 BindingDB Entry DOI: 10.7270/Q2319VK8
					More data for this Ligand-Target Pair
Coagulation factor VII (Homo sapiens (Human))	BDBM50215421 (2-[6-(3-aminophenyl)-5-chloro-3-(cyclobutylamino)-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cn2c(c(Cl)nc(NC3CCC3)c2=O)-c2cccc(N)c2)cc1O Show InChI InChI=1S/C24H26ClN7O3/c25-21-20(14-3-1-4-15(26)10-14)32(24(35)23(31-21)30-16-5-2-6-16)12-19(34)29-11-13-7-8-17(22(27)28)18(33)9-13/h1,3-4,7-10,16,33H,2,5-6,11-12,26H2,(H3,27,28)(H,29,34)(H,30,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	190	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of factor 7a				Bioorg Med Chem Lett 17: 4568-74 (2007) Article DOI: 10.1016/j.bmcl.2007.05.090 BindingDB Entry DOI: 10.7270/Q2319VK8
					More data for this Ligand-Target Pair
Prothrombin (Homo sapiens (Human))	BDBM50215421 (2-[6-(3-aminophenyl)-5-chloro-3-(cyclobutylamino)-...) Show SMILES NC(=N)c1ccc(CNC(=O)Cn2c(c(Cl)nc(NC3CCC3)c2=O)-c2cccc(N)c2)cc1O Show InChI InChI=1S/C24H26ClN7O3/c25-21-20(14-3-1-4-15(26)10-14)32(24(35)23(31-21)30-16-5-2-6-16)12-19(34)29-11-13-7-8-17(22(27)28)18(33)9-13/h1,3-4,7-10,16,33H,2,5-6,11-12,26H2,(H3,27,28)(H,29,34)(H,30,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of factor 2a				Bioorg Med Chem Lett 17: 4568-74 (2007) Article DOI: 10.1016/j.bmcl.2007.05.090 BindingDB Entry DOI: 10.7270/Q2319VK8
					More data for this Ligand-Target Pair