BDBM50296290 1-((S)-1-(2-((R)-2-(aminomethyl)pyrrolidin-1-yl)-2-oxoethyl)-2-oxoazepan-3-yl)-2-cyano-3-(2-methylbenzofuran-5-yl)guanidine::CHEMBL550040

SMILES: Cc1cc2cc(ccc2o1)N=C(NC#N)N[C@H]1CCCCN(CC(=O)N2CCC[C@@H]2CN)C1=O

InChI Key: InChIKey=BKYWKHMXTUNOOC-UXHICEINSA-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 = 50296290   

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))	BDBM50296290 (1-((S)-1-(2-((R)-2-(aminomethyl)pyrrolidin-1-yl)-2...) Show SMILES Cc1cc2cc(ccc2o1)N=C(NC#N)N[C@H]1CCCCN(CC(=O)N2CCC[C@@H]2CN)C1=O |r,w:10.11| Show InChI InChI=1S/C24H31N7O3/c1-16-11-17-12-18(7-8-21(17)34-16)28-24(27-15-26)29-20-6-2-3-9-30(23(20)33)14-22(32)31-10-4-5-19(31)13-25/h7-8,11-12,19-20H,2-6,9-10,13-14,25H2,1H3,(H2,27,28,29)/t19-,20+/m1/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	22	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