BDBM266331 US9718790, I-2213

SMILES: CCn1c(=O)[nH]\c(=N/c2ccc(Oc3ccnc(NC(=O)NC4CC4)c3)cc2)n(Cc2ccc(Cl)cc2)c1=O

InChI Key: InChIKey=PUUFMHQZCPQYRZ-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 = 266331   

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))	BDBM266331 (US9718790, I-2213) Show SMILES CCn1c(=O)[nH]\c(=N/c2ccc(Oc3ccnc(NC(=O)NC4CC4)c3)cc2)n(Cc2ccc(Cl)cc2)c1=O Show InChI InChI=1S/C27H26ClN7O4/c1-2-34-26(37)33-24(35(27(34)38)16-17-3-5-18(28)6-4-17)30-19-9-11-21(12-10-19)39-22-13-14-29-23(15-22)32-25(36)31-20-7-8-20/h3-6,9-15,20H,2,7-8,16H2,1H3,(H,30,33,37)(H2,29,31,32,36)	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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