BDBM50262228 (S)-N-((m-toluidino)(2-oxo-1-(2-oxo-2-(pyrrolidin-1-yl)ethyl)azepan-3-ylamino)methylene)-4-(dimethylamino)benzamide::CHEMBL467967

SMILES: CN(C)c1ccc(cc1)C(=O)NC(Nc1cccc(C)c1)=N[C@H]1CCCCN(CC(=O)N2CCCC2)C1=O

InChI Key: InChIKey=LPVFYYGBISHNCR-VWLOTQADSA-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 = 50262228   

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))	BDBM50262228 ((S)-N-((m-toluidino)(2-oxo-1-(2-oxo-2-(pyrrolidin-...) Show SMILES CN(C)c1ccc(cc1)C(=O)NC(Nc1cccc(C)c1)=N[C@H]1CCCCN(CC(=O)N2CCCC2)C1=O |r,w:12.13| Show InChI InChI=1S/C29H38N6O3/c1-21-9-8-10-23(19-21)30-29(32-27(37)22-12-14-24(15-13-22)33(2)3)31-25-11-4-5-18-35(28(25)38)20-26(36)34-16-6-7-17-34/h8-10,12-15,19,25H,4-7,11,16-18,20H2,1-3H3,(H2,30,31,32,37)/t25-/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	517	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