BDBM50262230 (S)-N-((m-toluidino)(2-oxo-1-(2-oxo-2-(pyrrolidin-1-yl)ethyl)azepan-3-ylamino)methylene)-4-chlorobenzamide::CHEMBL469174

SMILES: Cc1cccc(NC(NC(=O)c2ccc(Cl)cc2)=N[C@H]2CCCCN(CC(=O)N3CCCC3)C2=O)c1

InChI Key: InChIKey=RMZRWWOZDWONKS-QHCPKHFHSA-N

Data: 1 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 1 hit for monomerid = 50262230   

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))	BDBM50262230 ((S)-N-((m-toluidino)(2-oxo-1-(2-oxo-2-(pyrrolidin-...) Show SMILES Cc1cccc(NC(NC(=O)c2ccc(Cl)cc2)=N[C@H]2CCCCN(CC(=O)N3CCCC3)C2=O)c1 |r,w:7.6| Show InChI InChI=1S/C27H32ClN5O3/c1-19-7-6-8-22(17-19)29-27(31-25(35)20-10-12-21(28)13-11-20)30-23-9-2-3-16-33(26(23)36)18-24(34)32-14-4-5-15-32/h6-8,10-13,17,23H,2-5,9,14-16,18H2,1H3,(H2,29,30,31,35)/t23-/m0/s1	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	198	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Research and Development Curated by ChEMBL					Assay Description Inhibition of human factor 10a				Bioorg Med Chem Lett 18: 4696-9 (2008) Article DOI: 10.1016/j.bmcl.2008.07.004 BindingDB Entry DOI: 10.7270/Q2QV3MBT
					More data for this Ligand-Target Pair