null

SMILES: CC(C)Oc1ccc(cc1F)\N=c1/[nH]c(=O)n(CCC(=O)NCC#N)c(=O)n1Cc1ccc(Cl)cc1

InChI Key: InChIKey=KKWDEJBVLDOLBA-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 183271   

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))	BDBM183271 (US9150546, I-439 | US9688643, I-439 | US9718790, I...) Show SMILES CC(C)Oc1ccc(cc1F)\N=c1/[nH]c(=O)n(CCC(=O)NCC#N)c(=O)n1Cc1ccc(Cl)cc1 Show InChI InChI=1S/C24H24ClFN6O4/c1-15(2)36-20-8-7-18(13-19(20)26)29-22-30-23(34)31(12-9-21(33)28-11-10-27)24(35)32(22)14-16-3-5-17(25)6-4-16/h3-8,13,15H,9,11-12,14H2,1-2H3,(H,28,33)(H,29,30,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	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))	BDBM183271 (US9150546, I-439 | US9688643, I-439 | US9718790, I...) Show SMILES CC(C)Oc1ccc(cc1F)\N=c1/[nH]c(=O)n(CCC(=O)NCC#N)c(=O)n1Cc1ccc(Cl)cc1 Show InChI InChI=1S/C24H24ClFN6O4/c1-15(2)36-20-8-7-18(13-19(20)26)29-22-30-23(34)31(12-9-21(33)28-11-10-27)24(35)32(22)14-16-3-5-17(25)6-4-16/h3-8,13,15H,9,11-12,14H2,1-2H3,(H,28,33)(H,29,30,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	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))	BDBM183271 (US9150546, I-439 | US9688643, I-439 | US9718790, I...) Show SMILES CC(C)Oc1ccc(cc1F)\N=c1/[nH]c(=O)n(CCC(=O)NCC#N)c(=O)n1Cc1ccc(Cl)cc1 Show InChI InChI=1S/C24H24ClFN6O4/c1-15(2)36-20-8-7-18(13-19(20)26)29-22-30-23(34)31(12-9-21(33)28-11-10-27)24(35)32(22)14-16-3-5-17(25)6-4-16/h3-8,13,15H,9,11-12,14H2,1-2H3,(H,28,33)(H,29,30,34)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	18	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