Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 7' and Ligand = 'BDBM246974'   

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 7 (Homo sapiens (Human))	BDBM246974 ((S)-8-(4-methoxypyridin-2-yl)-5-methyl-3-(2-methyl...) Show SMILES COc1ccnc(c1)-c1nnc2-c3nnc(-c4cccc(c4C)C(F)(F)F)n3[C@@H](C)Cn12 |r| Show InChI InChI=1S/C21H18F3N7O/c1-11-10-30-18(16-9-13(32-3)7-8-25-16)27-28-19(30)20-29-26-17(31(11)20)14-5-4-6-15(12(14)2)21(22,23)24/h4-9,11H,10H2,1-3H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description human or rat P2X7-1321N1 cells were collected and frozen @−80° C. On the day of the experiment, cell membrane preparations were made according ...				US Patent US10053463 (2018) BindingDB Entry DOI: 10.7270/Q2FT8P24
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Mus musculus)	BDBM246974 ((S)-8-(4-methoxypyridin-2-yl)-5-methyl-3-(2-methyl...) Show SMILES COc1ccnc(c1)-c1nnc2-c3nnc(-c4cccc(c4C)C(F)(F)F)n3[C@@H](C)Cn12 |r| Show InChI InChI=1S/C21H18F3N7O/c1-11-10-30-18(16-9-13(32-3)7-8-25-16)27-28-19(30)20-29-26-17(31(11)20)14-5-4-6-15(12(14)2)21(22,23)24/h4-9,11H,10H2,1-3H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutica NV US Patent					Assay Description human or rat P2X7-1321N1 cells were collected and frozen @−80° C. On the day of the experiment, cell membrane preparations were made according ...				US Patent US10053463 (2018) BindingDB Entry DOI: 10.7270/Q2FT8P24
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Mus musculus)	BDBM246974 ((S)-8-(4-methoxypyridin-2-yl)-5-methyl-3-(2-methyl...) Show SMILES COc1ccnc(c1)-c1nnc2-c3nnc(-c4cccc(c4C)C(F)(F)F)n3[C@@H](C)Cn12 |r| Show InChI InChI=1S/C21H18F3N7O/c1-11-10-30-18(16-9-13(32-3)7-8-25-16)27-28-19(30)20-29-26-17(31(11)20)14-5-4-6-15(12(14)2)21(22,23)24/h4-9,11H,10H2,1-3H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	19.5	n/a	n/a	n/a	n/a	7.4	n/a
Janssen Pharmaceutica NV US Patent					Assay Description 1321N1 cells expressing the recombinant human or rat P2X7 channel was cultured in HyQ DME/(HyClone/Dulbecco's Modified Eagle Medium) high glucose...				US Patent US10053463 (2018) BindingDB Entry DOI: 10.7270/Q2FT8P24
					More data for this Ligand-Target Pair