Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'P2X purinoceptor 7' and Ligand = 'BDBM246943'   

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))	BDBM246943 ((5S)-3-(2,3-Dichlorophenyl)-5-methyl-8-pyrazin-2-y...) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)-c2nnc(-c3cccc(Cl)c3Cl)n12 |r| Show InChI InChI=1S/C17H12Cl2N8/c1-9-8-26-15(12-7-20-5-6-21-12)23-24-16(26)17-25-22-14(27(9)17)10-3-2-4-11(18)13(10)19/h2-7,9H,8H2,1H3/t9-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	20	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)	BDBM246943 ((5S)-3-(2,3-Dichlorophenyl)-5-methyl-8-pyrazin-2-y...) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)-c2nnc(-c3cccc(Cl)c3Cl)n12 |r| Show InChI InChI=1S/C17H12Cl2N8/c1-9-8-26-15(12-7-20-5-6-21-12)23-24-16(26)17-25-22-14(27(9)17)10-3-2-4-11(18)13(10)19/h2-7,9H,8H2,1H3/t9-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	20	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 (Homo sapiens (Human))	BDBM246943 ((5S)-3-(2,3-Dichlorophenyl)-5-methyl-8-pyrazin-2-y...) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)-c2nnc(-c3cccc(Cl)c3Cl)n12 |r| Show InChI InChI=1S/C17H12Cl2N8/c1-9-8-26-15(12-7-20-5-6-21-12)23-24-16(26)17-25-22-14(27(9)17)10-3-2-4-11(18)13(10)19/h2-7,9H,8H2,1H3/t9-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.70	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
P2X purinoceptor 7 (Mus musculus)	BDBM246943 ((5S)-3-(2,3-Dichlorophenyl)-5-methyl-8-pyrazin-2-y...) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)-c2nnc(-c3cccc(Cl)c3Cl)n12 |r| Show InChI InChI=1S/C17H12Cl2N8/c1-9-8-26-15(12-7-20-5-6-21-12)23-24-16(26)17-25-22-14(27(9)17)10-3-2-4-11(18)13(10)19/h2-7,9H,8H2,1H3/t9-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	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