BDBM266387 US9718790, I-2233

SMILES: CCn1c(=O)[nH]\c(=N/c2ccc(Oc3cc(F)cc(c3)C(N)=O)cc2)n(Cc2ccc(Cl)cc2)c1=O

InChI Key: InChIKey=OIAAYNIWLJLLSJ-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 266387   

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
P2X purinoceptor 3 (Homo sapiens (Human))	BDBM266387 (US9718790, I-2233) Show SMILES CCn1c(=O)[nH]\c(=N/c2ccc(Oc3cc(F)cc(c3)C(N)=O)cc2)n(Cc2ccc(Cl)cc2)c1=O Show InChI InChI=1S/C25H21ClFN5O4/c1-2-31-24(34)30-23(32(25(31)35)14-15-3-5-17(26)6-4-15)29-19-7-9-20(10-8-19)36-21-12-16(22(28)33)11-18(27)13-21/h3-13H,2,14H2,1H3,(H2,28,33)(H,29,30,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	7.5	n/a
SHIONOGI & CO., LTD. US Patent					Assay Description Stably expressing cell line (C6BU-1 transfected with human P2X3 receptor gene (GenBank accession number Y07683) was used. The cells were seeded in a ...				US Patent US9718790 (2017) BindingDB Entry DOI: 10.7270/Q22809KB
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