Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 3' and Ligand = 'BDBM183371'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
P2X purinoceptor 3 (Homo sapiens (Human))	BDBM183371 (US9150546, I-545 | US9688643, I-545 | US9718790, I...) Show SMILES CC(C)Oc1ccc(Nc2nc(=O)n(CCOC3CCCCO3)c(=O)n2Cc2ccc(Cl)cc2)cc1F Show InChI InChI=1S/C26H30ClFN4O5/c1-17(2)37-22-11-10-20(15-21(22)28)29-24-30-25(33)31(12-14-36-23-5-3-4-13-35-23)26(34)32(24)16-18-6-8-19(27)9-7-18/h6-11,15,17,23H,3-5,12-14,16H2,1-2H3,(H,29,30,33)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	7.5	37
SHIONOGI & CO., LTD. US Patent					Assay Description Stably expressing cell line (C6BU-1 cell transfected with human P2X3 receptor gene (GenBank accession number Y07683)) was used. The cells were seeded...				US Patent US9150546 (2015) BindingDB Entry DOI: 10.7270/Q2416VV1
					More data for this Ligand-Target Pair
P2X purinoceptor 3 (Homo sapiens (Human))	BDBM183371 (US9150546, I-545 | US9688643, I-545 | US9718790, I...) Show SMILES CC(C)Oc1ccc(Nc2nc(=O)n(CCOC3CCCCO3)c(=O)n2Cc2ccc(Cl)cc2)cc1F Show InChI InChI=1S/C26H30ClFN4O5/c1-17(2)37-22-11-10-20(15-21(22)28)29-24-30-25(33)31(12-14-36-23-5-3-4-13-35-23)26(34)32(24)16-18-6-8-19(27)9-7-18/h6-11,15,17,23H,3-5,12-14,16H2,1-2H3,(H,29,30,33)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	6	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
					More data for this Ligand-Target Pair
P2X purinoceptor 3 (Homo sapiens (Human))	BDBM183371 (US9150546, I-545 | US9688643, I-545 | US9718790, I...) Show SMILES CC(C)Oc1ccc(Nc2nc(=O)n(CCOC3CCCCO3)c(=O)n2Cc2ccc(Cl)cc2)cc1F Show InChI InChI=1S/C26H30ClFN4O5/c1-17(2)37-22-11-10-20(15-21(22)28)29-24-30-25(33)31(12-14-36-23-5-3-4-13-35-23)26(34)32(24)16-18-6-8-19(27)9-7-18/h6-11,15,17,23H,3-5,12-14,16H2,1-2H3,(H,29,30,33)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC US Patent					Assay Description Stably expressing cell line (C6BU-1 cell transfected with human P2X3 receptor gene (GenBank accession number Y07683)) was used. The cells were seeded...				US Patent US9688643 (2017) BindingDB Entry DOI: 10.7270/Q2M32SZ2
					More data for this Ligand-Target Pair