BDBM50296285 (+/-)-2-cyano-1-(2-methylbenzofuran-5-yl)-3-(2-oxo-1-(2-oxo-2-(pyrrolidin-1-yl)ethyl)azocan-3-yl)guanidine::CHEMBL564521

SMILES: Cc1cc2cc(ccc2o1)N=C(NC#N)NC1CCCCCN(CC(=O)N2CCCC2)C1=O

InChI Key: InChIKey=GJSIDPZVYHJMJY-UHFFFAOYSA-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 = 50296285   

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))	BDBM50296285 ((+/-)-2-cyano-1-(2-methylbenzofuran-5-yl)-3-(2-oxo...) Show SMILES Cc1cc2cc(ccc2o1)N=C(NC#N)NC1CCCCCN(CC(=O)N2CCCC2)C1=O |w:10.11| Show InChI InChI=1S/C24H30N6O3/c1-17-13-18-14-19(8-9-21(18)33-17)27-24(26-16-25)28-20-7-3-2-4-12-30(23(20)32)15-22(31)29-10-5-6-11-29/h8-9,13-14,20H,2-7,10-12,15H2,1H3,(H2,26,27,28)	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	195	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Company Curated by ChEMBL					Assay Description Inhibition of human factor 10a-mediated cleavage of synthetic substrate S-2222				Bioorg Med Chem Lett 19: 4034-41 (2009) Article DOI: 10.1016/j.bmcl.2009.06.014 BindingDB Entry DOI: 10.7270/Q2TQ61KM
					More data for this Ligand-Target Pair