Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 3' and Ligand = 'BDBM183227'   

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))	BDBM183227 (US9150546, I-397 | US9688643, I-397 | US9718790, I...) Show SMILES COC(=O)CNC(=O)Cn1c(=O)[nH]\c(=N/c2ccc(OC(C)C)c(F)c2)n(Cc2ccc(Cl)cc2)c1=O Show InChI InChI=1S/C24H25ClFN5O6/c1-14(2)37-19-9-8-17(10-18(19)26)28-22-29-23(34)31(13-20(32)27-11-21(33)36-3)24(35)30(22)12-15-4-6-16(25)7-5-15/h4-10,14H,11-13H2,1-3H3,(H,27,32)(H,28,29,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19	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))	BDBM183227 (US9150546, I-397 | US9688643, I-397 | US9718790, I...) Show SMILES COC(=O)CNC(=O)Cn1c(=O)[nH]\c(=N/c2ccc(OC(C)C)c(F)c2)n(Cc2ccc(Cl)cc2)c1=O Show InChI InChI=1S/C24H25ClFN5O6/c1-14(2)37-19-9-8-17(10-18(19)26)28-22-29-23(34)31(13-20(32)27-11-21(33)36-3)24(35)30(22)12-15-4-6-16(25)7-5-15/h4-10,14H,11-13H2,1-3H3,(H,27,32)(H,28,29,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19	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))	BDBM183227 (US9150546, I-397 | US9688643, I-397 | US9718790, I...) Show SMILES COC(=O)CNC(=O)Cn1c(=O)[nH]\c(=N/c2ccc(OC(C)C)c(F)c2)n(Cc2ccc(Cl)cc2)c1=O Show InChI InChI=1S/C24H25ClFN5O6/c1-14(2)37-19-9-8-17(10-18(19)26)28-22-29-23(34)31(13-20(32)27-11-21(33)36-3)24(35)30(22)12-15-4-6-16(25)7-5-15/h4-10,14H,11-13H2,1-3H3,(H,27,32)(H,28,29,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19	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