BDBM285855 3-[5-chloro-2-(1H-tetrazol- 1-yl)phenyl]-7-[4-(3- fluorophenyl)-1H- imidazol-2-yl]-6,7- dihydro-5H- cyclopenta[b]pyridine-1- oxide::US10081617, Example 3

SMILES: [O-][n+]1cc(cc2CCC(c3ncc([nH]3)-c3cccc(F)c3)c12)-c1cc(Cl)ccc1-n1cnnn1

InChI Key:

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 = 285855   

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 XI (Homo sapiens (Human))	BDBM285855 (3-[5-chloro-2-(1H-tetrazol- 1-yl)phenyl]-7-[4-(3- ...) Show SMILES [O-][n+]1cc(cc2CCC(c3ncc([nH]3)-c3cccc(F)c3)c12)-c1cc(Cl)ccc1-n1cnnn1 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	30	n/a	n/a	n/a	n/a	7.4	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Factor XIa determinations were made in 50 mM HEPES buffer at pH 7.4 containing 150 mM NaCl, 5 mM CaCl2, and 0.1% PEG 8000 (polyethylene glycol; JT Ba...				US Patent US10081617 (2018) BindingDB Entry DOI: 10.7270/Q2CR5WDN
					More data for this Ligand-Target Pair