Compile Data Set for Download or QSAR

Found 45 hits Enz. Inhib. hit(s) with all data for entry = 50046870   

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))	BDBM160076 (US10047092, 17 | US10053463, 17 | US9040534, 17) Show SMILES C[C@H]1Cn2c(nnc2-c2ccc(F)cc2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C20H15ClF4N4O/c1-11-9-29-17(12-5-7-14(22)8-6-12)26-27-18(29)19(30)28(11)10-13-3-2-4-15(16(13)21)20(23,24)25/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160077 (US10047092, 18 | US10053463, 18 | US9040534, 18) Show SMILES C[C@H]1Cn2c(nnc2-c2ccccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-28-16(14-7-2-3-8-24-14)25-26-17(28)18(29)27(11)10-12-5-4-6-13(15(12)20)19(21,22)23/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM48901 (BDBM160086 | US10047092, 27 | US10053463, 27 | US9...) Show SMILES C[C@H]1Cn2c(nnc2-c2ncccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(14-23-6-3-7-24-14)25-26-16(28)17(29)27(10)9-11-4-2-5-12(13(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160087 (US10047092, 28 | US10053463, 28 | US9040534, 28) Show SMILES C[C@H]1Cn2c(nnc2C(=O)N1Cc1cccc(c1Cl)C(F)(F)F)-c1cc[nH]n1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160075 (US10047092, 16 | US9040534, 16) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160089 (US10047092, 30 | US10053463, 30 | US9040534, 30) Show SMILES C[C@H]1Cn2c(nnc2-c2ccc(F)cn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H14ClF4N5O/c1-10-8-29-16(14-6-5-12(21)7-25-14)26-27-17(29)18(30)28(10)9-11-3-2-4-13(15(11)20)19(22,23)24/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160072 (US10047092, 13 | US9040534, 13) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(Cl)c1Cl |r| Show InChI InChI=1S/C17H14Cl2N6O/c1-10-8-25-15(13-7-20-5-6-21-13)22-23-16(25)17(26)24(10)9-11-3-2-4-12(18)14(11)19/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160088 (US10047092, 29 | US10053463, 29 | US9040534, 29) Show SMILES C[C@H]1Cn2c(nnc2-c2cccnc2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-28-16(12-5-3-7-24-8-12)25-26-17(28)18(29)27(11)10-13-4-2-6-14(15(13)20)19(21,22)23/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.90	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160144 (US10047092, 85 | US10053463, 85 | US9040534, 85) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1C)C(F)(F)F |r| Show InChI InChI=1S/C19H17F3N6O/c1-11-9-28-16(15-8-23-6-7-24-15)25-26-17(28)18(29)27(11)10-13-4-3-5-14(12(13)2)19(20,21)22/h3-8,11H,9-10H2,1-2H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160073 (US10047092, 14 | US9040534, 14) Show SMILES CC1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.40	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160147 (US10047092, 88 | US10053463, 88 | US9040534, 88) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C18H15F3N6O/c1-11-9-27-15(14-8-22-5-6-23-14)24-25-16(27)17(28)26(11)10-12-3-2-4-13(7-12)18(19,20)21/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.60	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160092 (US10047092, 33 | US10053463, 33 | US9040534, 33) Show SMILES C[C@H]1Cn2c(nnc2-c2ccncn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-7-28-15(13-5-6-23-9-24-13)25-26-16(28)17(29)27(10)8-11-3-2-4-12(14(11)19)18(20,21)22/h2-6,9-10H,7-8H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.80	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160082 (US10047092, 23 | US10053463, 23 | US9040534, 23) Show SMILES C[C@H]1Cn2c(nnc2C(=O)N1Cc1cccc(c1Cl)C(F)(F)F)-c1ccn(C)n1 |r| Show InChI InChI=1S/C18H16ClF3N6O/c1-10-8-28-15(13-6-7-26(2)25-13)23-24-16(28)17(29)27(10)9-11-4-3-5-12(14(11)19)18(20,21)22/h3-7,10H,8-9H2,1-2H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.20	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160111 (US10047092, 52 | US10053463, 52 | US9040534, 52) Show SMILES C[C@H]1Cn2c(nnc2-c2cncc(Cl)c2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H14Cl2F3N5O/c1-10-8-29-16(12-5-13(20)7-25-6-12)26-27-17(29)18(30)28(10)9-11-3-2-4-14(15(11)21)19(22,23)24/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160087 (US10047092, 28 | US10053463, 28 | US9040534, 28) Show SMILES C[C@H]1Cn2c(nnc2C(=O)N1Cc1cccc(c1Cl)C(F)(F)F)-c1cc[nH]n1 |r| Show InChI	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.10	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160075 (US10047092, 16 | US9040534, 16) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Displacement of [3H]JNJ-54232334 from P2X7 receptor in rat hippocampal membranes				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM48901 (BDBM160086 | US10047092, 27 | US10053463, 27 | US9...) Show SMILES C[C@H]1Cn2c(nnc2-c2ncccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(14-23-6-3-7-24-14)25-26-16(28)17(29)27(10)9-11-4-2-5-12(13(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160073 (US10047092, 14 | US9040534, 14) Show SMILES CC1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160152 (US10047092, 93 | US10053463, 93 | US9040534, 93) Show SMILES CC(N1[C@@H](C)Cn2c(nnc2-c2cnccn2)C1=O)c1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H16ClF3N6O/c1-10-9-28-16(14-8-24-6-7-25-14)26-27-17(28)18(30)29(10)11(2)12-4-3-5-13(15(12)20)19(21,22)23/h3-8,10-11H,9H2,1-2H3/t10-,11?/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160145 (US10047092, 86 | US10053463, 86 | US9040534, 86) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C17H14Cl2N6O/c1-10-8-25-15(14-7-20-5-6-21-14)22-23-16(25)17(26)24(10)9-11-12(18)3-2-4-13(11)19/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160075 (US10047092, 16 | US9040534, 16) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	79	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160088 (US10047092, 29 | US10053463, 29 | US9040534, 29) Show SMILES C[C@H]1Cn2c(nnc2-c2cccnc2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-28-16(12-5-3-7-24-8-12)25-26-17(28)18(29)27(11)10-13-4-2-6-14(15(13)20)19(21,22)23/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	88	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160072 (US10047092, 13 | US9040534, 13) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(Cl)c1Cl |r| Show InChI InChI=1S/C17H14Cl2N6O/c1-10-8-25-15(13-7-20-5-6-21-13)22-23-16(25)17(26)24(10)9-11-3-2-4-12(18)14(11)19/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	103	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160139 (US10047092, 80 | US10053463, 80 | US9040534, 80) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1ccccc1Cl |r| Show InChI InChI=1S/C17H15ClN6O/c1-11-9-24-15(14-8-19-6-7-20-14)21-22-16(24)17(25)23(11)10-12-4-2-3-5-13(12)18/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	216	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160077 (US10047092, 18 | US10053463, 18 | US9040534, 18) Show SMILES C[C@H]1Cn2c(nnc2-c2ccccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H15ClF3N5O/c1-11-9-28-16(14-7-2-3-8-24-14)25-26-17(28)18(29)27(11)10-12-5-4-6-13(15(12)20)19(21,22)23/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160089 (US10047092, 30 | US10053463, 30 | US9040534, 30) Show SMILES C[C@H]1Cn2c(nnc2-c2ccc(F)cn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H14ClF4N5O/c1-10-8-29-16(14-6-5-12(21)7-25-14)26-27-17(29)18(30)28(10)9-11-3-2-4-13(15(11)20)19(22,23)24/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	380	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160062 (US10047092, 3 | US10053463, 3 | US9040534, 3) Show SMILES FC(F)(F)c1cccc(CN2CCn3c(nnc3-c3cnccn3)C2=O)c1Cl Show InChI InChI=1S/C17H12ClF3N6O/c18-13-10(2-1-3-11(13)17(19,20)21)9-26-6-7-27-14(12-8-22-4-5-23-12)24-25-15(27)16(26)28/h1-5,8H,6-7,9H2	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	440	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160144 (US10047092, 85 | US10053463, 85 | US9040534, 85) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1C)C(F)(F)F |r| Show InChI InChI=1S/C19H17F3N6O/c1-11-9-28-16(15-8-23-6-7-24-15)25-26-17(28)18(29)27(11)10-13-4-3-5-14(12(13)2)19(20,21)22/h3-8,11H,9-10H2,1-2H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	506	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160082 (US10047092, 23 | US10053463, 23 | US9040534, 23) Show SMILES C[C@H]1Cn2c(nnc2C(=O)N1Cc1cccc(c1Cl)C(F)(F)F)-c1ccn(C)n1 |r| Show InChI InChI=1S/C18H16ClF3N6O/c1-10-8-28-15(13-6-7-26(2)25-13)23-24-16(28)17(29)27(10)9-11-4-3-5-12(14(11)19)18(20,21)22/h3-7,10H,8-9H2,1-2H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	960	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160145 (US10047092, 86 | US10053463, 86 | US9040534, 86) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1c(Cl)cccc1Cl |r| Show InChI InChI=1S/C17H14Cl2N6O/c1-10-8-25-15(14-7-20-5-6-21-14)22-23-16(25)17(26)24(10)9-11-12(18)3-2-4-13(11)19/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.38E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160152 (US10047092, 93 | US10053463, 93 | US9040534, 93) Show SMILES CC(N1[C@@H](C)Cn2c(nnc2-c2cnccn2)C1=O)c1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H16ClF3N6O/c1-10-9-28-16(14-8-24-6-7-25-14)26-27-17(28)18(30)29(10)11(2)12-4-3-5-13(15(12)20)19(21,22)23/h3-8,10-11H,9H2,1-2H3/t10-,11?/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160076 (US10047092, 17 | US10053463, 17 | US9040534, 17) Show SMILES C[C@H]1Cn2c(nnc2-c2ccc(F)cc2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C20H15ClF4N4O/c1-11-9-29-17(12-5-7-14(22)8-6-12)26-27-18(29)19(30)28(11)10-13-3-2-4-15(16(13)21)20(23,24)25/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.61E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160147 (US10047092, 88 | US10053463, 88 | US9040534, 88) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1)C(F)(F)F |r| Show InChI InChI=1S/C18H15F3N6O/c1-11-9-27-15(14-8-22-5-6-23-14)24-25-16(27)17(28)26(11)10-12-3-2-4-13(7-12)18(19,20)21/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160074 (US10047092, 15 | US10053463, 15 | US9040534, 15) Show SMILES C[C@@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.71E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160111 (US10047092, 52 | US10053463, 52 | US9040534, 52) Show SMILES C[C@H]1Cn2c(nnc2-c2cncc(Cl)c2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C19H14Cl2F3N5O/c1-10-8-29-16(12-5-13(20)7-25-6-12)26-27-17(29)18(30)28(10)9-11-3-2-4-14(15(11)21)19(22,23)24/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM160138 (US10047092, 79 | US10053463, 79 | US9040534, 79) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1ccccc1 |r| Show InChI InChI=1S/C17H16N6O/c1-12-10-23-15(14-9-18-7-8-19-14)20-21-16(23)17(24)22(12)11-13-5-3-2-4-6-13/h2-9,12H,10-11H2,1H3/t12-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.96E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM160075 (US10047092, 16 | US9040534, 16) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Inhibition of CYP2C19 (unknown origin)				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160062 (US10047092, 3 | US10053463, 3 | US9040534, 3) Show SMILES FC(F)(F)c1cccc(CN2CCn3c(nnc3-c3cnccn3)C2=O)c1Cl Show InChI InChI=1S/C17H12ClF3N6O/c18-13-10(2-1-3-11(13)17(19,20)21)9-26-6-7-27-14(12-8-22-4-5-23-12)24-25-15(27)16(26)28/h1-5,8H,6-7,9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.67E+3	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160138 (US10047092, 79 | US10053463, 79 | US9040534, 79) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1ccccc1 |r| Show InChI InChI=1S/C17H16N6O/c1-12-10-23-15(14-9-18-7-8-19-14)20-21-16(23)17(24)22(12)11-13-5-3-2-4-6-13/h2-9,12H,10-11H2,1H3/t12-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160092 (US10047092, 33 | US10053463, 33 | US9040534, 33) Show SMILES C[C@H]1Cn2c(nnc2-c2ccncn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-7-28-15(13-5-6-23-9-24-13)25-26-16(28)17(29)27(10)8-11-3-2-4-12(14(11)19)18(20,21)22/h2-6,9-10H,7-8H2,1H3/t10-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM160075 (US10047092, 16 | US9040534, 16) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Displacement of dofetilide from human ERG channel				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160074 (US10047092, 15 | US10053463, 15 | US9040534, 15) Show SMILES C[C@@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1cccc(c1Cl)C(F)(F)F |r| Show InChI InChI=1S/C18H14ClF3N6O/c1-10-8-28-15(13-7-23-5-6-24-13)25-26-16(28)17(29)27(10)9-11-3-2-4-12(14(11)19)18(20,21)22/h2-7,10H,8-9H2,1H3/t10-/m1/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM50134732 (CHEMBL3746675) Show SMILES FC(F)(F)c1cccc(CN2CCc3c(nnn3-c3cnccn3)C2=O)c1Cl Show InChI InChI=1S/C17H12ClF3N6O/c18-14-10(2-1-3-11(14)17(19,20)21)9-26-7-4-12-15(16(26)28)24-25-27(12)13-8-22-5-6-23-13/h1-3,5-6,8H,4,7,9H2	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM50134732 (CHEMBL3746675) Show SMILES FC(F)(F)c1cccc(CN2CCc3c(nnn3-c3cnccn3)C2=O)c1Cl Show InChI InChI=1S/C17H12ClF3N6O/c18-14-10(2-1-3-11(14)17(19,20)21)9-26-7-4-12-15(16(26)28)24-25-27(12)13-8-22-5-6-23-13/h1-3,5-6,8H,4,7,9H2	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at human P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Rattus norvegicus (Rat))	BDBM160139 (US10047092, 80 | US10053463, 80 | US9040534, 80) Show SMILES C[C@H]1Cn2c(nnc2-c2cnccn2)C(=O)N1Cc1ccccc1Cl |r| Show InChI InChI=1S/C17H15ClN6O/c1-11-9-24-15(14-8-19-6-7-20-14)21-22-16(24)17(25)23(11)10-12-4-2-3-5-13(12)18/h2-8,11H,9-10H2,1H3/t11-/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Janssen Pharmaceutical Research& Development L.L.C. Curated by ChEMBL					Assay Description Antagonist activity at rat P2X7 receptor expressed in 1321N1 cells assessed as inhibition of Bz-ATP-induced Ca2+ flux after 30 mins by FLIPR assay				Bioorg Med Chem Lett 26: 257-61 (2016) Article DOI: 10.1016/j.bmcl.2015.12.052 BindingDB Entry DOI: 10.7270/Q2MW2K0Z
					More data for this Ligand-Target Pair