Compile Data Set for Download or QSAR

Found 223 hits Enz. Inhib. hit(s) with all data for entry = 8346   

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))	BDBM242031 (US9415055, 2,3-Dichloro-N-[2-(4,4-difluoro-piperid...) Show SMILES Fc1ccc(cc1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C20H19Cl2F3N2O/c21-16-3-1-2-15(18(16)22)19(28)26-12-17(13-4-6-14(23)7-5-13)27-10-8-20(24,25)9-11-27/h1-7,17H,8-12H2,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.330	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242026 (US9415055, 2-Chloro-N-[(S)-2-(4-chloro-phenyl)-2-m...) Show SMILES Cc1cccc(C(=O)NC[C@@H](N2CCOCC2)c2ccc(Cl)cc2)c1Cl Show InChI InChI=1S/C20H22Cl2N2O2/c1-14-3-2-4-17(19(14)22)20(25)23-13-18(24-9-11-26-12-10-24)15-5-7-16(21)8-6-15/h2-8,18H,9-13H2,1H3,(H,23,25)/t18-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.530	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242222 (US9415055, 2,3-Dichloro-N-[2-(4-chloro-phenyl)-2-m...) Show SMILES Clc1ccc(cc1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C19H19Cl3N2O2/c20-14-6-4-13(5-7-14)17(24-8-10-26-11-9-24)12-23-19(25)15-2-1-3-16(21)18(15)22/h1-7,17H,8-12H2,(H,23,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242040 (US9415055, 2,3-dichloro-N-[2-(4,4-difluoro-1-piper...) Show SMILES COc1ccc(cc1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C21H22Cl2F2N2O2/c1-29-15-7-5-14(6-8-15)18(27-11-9-21(24,25)10-12-27)13-26-20(28)16-3-2-4-17(22)19(16)23/h2-8,18H,9-13H2,1H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242021 (US9415055, 2,3-Dichloro-N-[(S)-2-(4-chloro-phenyl)...) Show SMILES Clc1ccc(cc1)[C@@H](CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 |r| Show InChI InChI=1S/C19H19Cl3N2O2/c20-14-6-4-13(5-7-14)17(24-8-10-26-11-9-24)12-23-19(25)15-2-1-3-16(21)18(15)22/h1-7,17H,8-12H2,(H,23,25)/t17-/m1/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.620	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242080 (US9415055, (+)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES Fc1cccc(Cl)c1C(=O)NCC(N1CCC(F)(F)CC1)c1ccc(nc1)C(F)(F)F Show InChI InChI=1S/C20H18ClF6N3O/c21-13-2-1-3-14(22)17(13)18(31)29-11-15(30-8-6-19(23,24)7-9-30)12-4-5-16(28-10-12)20(25,26)27/h1-5,10,15H,6-9,11H2,(H,29,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.620	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242069 (US9415055, 2,3-dichloro-N-[2-(4,4-difluoro-1-piper...) Show SMILES FC(F)(F)c1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H17Cl2F5N4O/c20-13-3-1-2-12(15(13)21)16(31)27-10-14(30-6-4-18(22,23)5-7-30)11-8-28-17(29-9-11)19(24,25)26/h1-3,8-9,14H,4-7,10H2,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.650	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242041 (US9415055, 2,3-dichloro-N-[2-(4,4-difluoro-1-piper...) Show SMILES Fc1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H18Cl2F3N3O/c20-14-3-1-2-13(17(14)21)18(28)26-11-15(12-4-5-16(22)25-10-12)27-8-6-19(23,24)7-9-27/h1-5,10,15H,6-9,11H2,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.890	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242043 (US9415055, 2,3-dichloro-N-[2-(4,4-difluoro-1-piper...) Show SMILES FC(F)(F)c1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C20H18Cl2F5N3O/c21-14-3-1-2-13(17(14)22)18(31)29-11-15(30-8-6-19(23,24)7-9-30)12-4-5-16(28-10-12)20(25,26)27/h1-5,10,15H,6-9,11H2,(H,29,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.30	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242110 (US9415055, (-)2-chloro-N-[2-(4-chlorophenyl)-2-mor...) Show SMILES COc1cccc(C(=O)NCC(N2CCOCC2)c2ccc(Cl)cc2)c1Cl Show InChI InChI=1S/C20H22Cl2N2O3/c1-26-18-4-2-3-16(19(18)22)20(25)23-13-17(24-9-11-27-12-10-24)14-5-7-15(21)8-6-14/h2-8,17H,9-13H2,1H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.5	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242078 (US9415055, (+)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES Fc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2ccc(nc2)C(F)(F)F)c1Cl Show InChI InChI=1S/C20H18ClF6N3O/c21-17-13(2-1-3-14(17)22)18(31)29-11-15(30-8-6-19(23,24)7-9-30)12-4-5-16(28-10-12)20(25,26)27/h1-5,10,15H,6-9,11H2,(H,29,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242093 (US9415055, (+)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES Fc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2cnc(nc2)C(F)(F)F)c1Cl Show InChI InChI=1S/C19H17ClF6N4O/c20-15-12(2-1-3-13(15)21)16(31)27-10-14(30-6-4-18(22,23)5-7-30)11-8-28-17(29-9-11)19(24,25)26/h1-3,8-9,14H,4-7,10H2,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.70	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242044 (US9415055, 2-chloro-N-[2-(4,4-difluoro-1-piperidyl...) Show SMILES FC(F)(F)c1ccc(cn1)C(CNC(=O)c1ccccc1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C20H19ClF5N3O/c21-15-4-2-1-3-14(15)18(30)28-12-16(29-9-7-19(22,23)8-10-29)13-5-6-17(27-11-13)20(24,25)26/h1-6,11,16H,7-10,12H2,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.80	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242221 (US9415055, (-)2-chloro-N-[2-[6-(difluoromethyl)-3-...) Show SMILES COc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2ccc(nc2)C(F)F)c1Cl Show InChI InChI=1S/C21H22ClF4N3O2/c1-31-17-4-2-3-14(18(17)22)20(30)28-12-16(29-9-7-21(25,26)8-10-29)13-5-6-15(19(23)24)27-11-13/h2-6,11,16,19H,7-10,12H2,1H3,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.90	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242019 (US9415055, N-[2-(4-Chloro-phenyl)-2-(4,4-difluoro-...) Show SMILES Cc1ccccc1C(=O)NCC(N1CCC(F)(F)CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C21H23ClF2N2O/c1-15-4-2-3-5-18(15)20(27)25-14-19(16-6-8-17(22)9-7-16)26-12-10-21(23,24)11-13-26/h2-9,19H,10-14H2,1H3,(H,25,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242038 (US9415055, (-)2,3-dichloro-N-[2-morpholino-2-[6-(t...) Show SMILES FC(F)(F)c1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C19H18Cl2F3N3O2/c20-14-3-1-2-13(17(14)21)18(28)26-11-15(27-6-8-29-9-7-27)12-4-5-16(25-10-12)19(22,23)24/h1-5,10,15H,6-9,11H2,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242148 (US9415055, (-)2,3-dichloro-N-[2-(4,4-difluoro-1-pi...) Show SMILES Fc1cc(Cl)c(Cl)c(c1)C(=O)NCC(N1CCC(F)(F)CC1)c1cnc(nc1)C(F)(F)F Show InChI InChI=1S/C19H16Cl2F6N4O/c20-13-6-11(22)5-12(15(13)21)16(32)28-9-14(31-3-1-18(23,24)2-4-31)10-7-29-17(30-8-10)19(25,26)27/h5-8,14H,1-4,9H2,(H,28,32)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242200 (US9415055, (-)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES COc1ccc(C(=O)NCC(N2CCC(F)(F)CC2)c2cnc(nc2)C(F)(F)F)c(Cl)c1 Show InChI InChI=1S/C20H20ClF5N4O2/c1-32-13-2-3-14(15(21)8-13)17(31)27-11-16(30-6-4-19(22,23)5-7-30)12-9-28-18(29-10-12)20(24,25)26/h2-3,8-10,16H,4-7,11H2,1H3,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242220 (US9415055, (+)2-chloro-N-[2-[6-(difluoromethyl)-3-...) Show SMILES COc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2ccc(nc2)C(F)F)c1Cl Show InChI InChI=1S/C21H22ClF4N3O2/c1-31-17-4-2-3-14(18(17)22)20(30)28-12-16(29-9-7-21(25,26)8-10-29)13-5-6-15(19(23)24)27-11-13/h2-6,11,16,19H,7-10,12H2,1H3,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.30	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242216 (US9415055, (+)2,3-dichloro-N-[2-[6-(difluoromethyl...) Show SMILES FC(F)c1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C20H19Cl2F4N3O/c21-14-3-1-2-13(17(14)22)19(30)28-11-16(29-8-6-20(25,26)7-9-29)12-4-5-15(18(23)24)27-10-12/h1-5,10,16,18H,6-9,11H2,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242109 (US9415055, 2,3-dichloro-N-(2-(2-methylpyrimidin-5-...) Show SMILES Cc1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CC(F)(F)C(F)(F)C1 Show InChI InChI=1S/C18H16Cl2F4N4O/c1-10-25-5-11(6-26-10)14(28-8-17(21,22)18(23,24)9-28)7-27-16(29)12-3-2-4-13(19)15(12)20/h2-6,14H,7-9H2,1H3,(H,27,29)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242106 (US9415055, (-)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES COc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2ccc(F)cc2)c1Cl Show InChI InChI=1S/C21H22ClF3N2O2/c1-29-18-4-2-3-16(19(18)22)20(28)26-13-17(14-5-7-15(23)8-6-14)27-11-9-21(24,25)10-12-27/h2-8,17H,9-13H2,1H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242107 (US9415055, (+)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES COc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2ccc(F)cc2)c1Cl Show InChI InChI=1S/C21H22ClF3N2O2/c1-29-18-4-2-3-16(19(18)22)20(28)26-13-17(14-5-7-15(23)8-6-14)27-11-9-21(24,25)10-12-27/h2-8,17H,9-13H2,1H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242179 (US9415055, (+)2,3-dichloro-N-[2-(4,4-difluoro-1-pi...) Show SMILES CCc1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C20H22Cl2F2N4O/c1-2-17-25-10-13(11-26-17)16(28-8-6-20(23,24)7-9-28)12-27-19(29)14-4-3-5-15(21)18(14)22/h3-5,10-11,16H,2,6-9,12H2,1H3,(H,27,29)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242070 (US9415055, 2-chloro-N-[2-(4,4-difluoro-1-piperidyl...) Show SMILES FC(F)(F)c1ncc(cn1)C(CNC(=O)c1ccccc1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H18ClF5N4O/c20-14-4-2-1-3-13(14)16(30)26-11-15(29-7-5-18(21,22)6-8-29)12-9-27-17(28-10-12)19(23,24)25/h1-4,9-10,15H,5-8,11H2,(H,26,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.80	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242081 (US9415055, (-)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES Fc1cccc(Cl)c1C(=O)NCC(N1CCC(F)(F)CC1)c1ccc(nc1)C(F)(F)F Show InChI InChI=1S/C20H18ClF6N3O/c21-13-2-1-3-14(22)17(13)18(31)29-11-15(30-8-6-19(23,24)7-9-30)12-4-5-16(28-10-12)20(25,26)27/h1-5,10,15H,6-9,11H2,(H,29,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242169 (US9415055, (+)2-chloro-N-[2-(2-cyclopropylpyrimidi...) Show SMILES FC1(F)CCN(CC1)C(CNC(=O)c1ccccc1Cl)c1cnc(nc1)C1CC1 Show InChI InChI=1S/C21H23ClF2N4O/c22-17-4-2-1-3-16(17)20(29)27-13-18(28-9-7-21(23,24)8-10-28)15-11-25-19(26-12-15)14-5-6-14/h1-4,11-12,14,18H,5-10,13H2,(H,27,29)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242034 (US9415055, (-)2,3-dichloro-N-[2-morpholino-2-[2-(t...) Show SMILES FC(F)(F)c1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C18H17Cl2F3N4O2/c19-13-3-1-2-12(15(13)20)16(28)24-10-14(27-4-6-29-7-5-27)11-8-25-17(26-9-11)18(21,22)23/h1-3,8-9,14H,4-7,10H2,(H,24,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242163 (US9415055, (+)2,3-dichloro-N-[2-(4,4-difluoro-1-pi...) Show SMILES Cc1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H20Cl2F2N4O/c1-12-24-9-13(10-25-12)16(27-7-5-19(22,23)6-8-27)11-26-18(28)14-3-2-4-15(20)17(14)21/h2-4,9-10,16H,5-8,11H2,1H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242182 (US9415055, (-)2,3-dichloro-N-[2-(2-cyclopropylpyri...) Show SMILES FC1(F)CCN(CC1)C(CNC(=O)c1cccc(Cl)c1Cl)c1cnc(nc1)C1CC1 Show InChI InChI=1S/C21H22Cl2F2N4O/c22-16-3-1-2-15(18(16)23)20(30)28-12-17(29-8-6-21(24,25)7-9-29)14-10-26-19(27-11-14)13-4-5-13/h1-3,10-11,13,17H,4-9,12H2,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.5	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242123 (US9415055, (+)2,3-dichloro-N-[2-(4-fluoro-1-piperi...) Show SMILES FC1CCN(CC1)C(CNC(=O)c1cccc(Cl)c1Cl)c1cnc(nc1)C(F)(F)F Show InChI InChI=1S/C19H18Cl2F4N4O/c20-14-3-1-2-13(16(14)21)17(30)26-10-15(29-6-4-12(22)5-7-29)11-8-27-18(28-9-11)19(23,24)25/h1-3,8-9,12,15H,4-7,10H2,(H,26,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.5	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242050 (US9415055, (-)2-chloro-3-methoxy-N-(2-morpholino-2...) Show SMILES COc1cccc(C(=O)NCC(N2CCOCC2)c2ccc(nc2)C(F)(F)F)c1Cl Show InChI InChI=1S/C20H21ClF3N3O3/c1-29-16-4-2-3-14(18(16)21)19(28)26-12-15(27-7-9-30-10-8-27)13-5-6-17(25-11-13)20(22,23)24/h2-6,11,15H,7-10,12H2,1H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.5	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242139 (US9415055, (+)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES COc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2cnc(nc2)C(F)(F)F)c1Cl Show InChI InChI=1S/C20H20ClF5N4O2/c1-32-15-4-2-3-13(16(15)21)17(31)27-11-14(30-7-5-19(22,23)6-8-30)12-9-28-18(29-10-12)20(24,25)26/h2-4,9-10,14H,5-8,11H2,1H3,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242020 (US9415055, N-[2-(4-Chloro-phenyl)-2-(4,4-difluoro-...) Show SMILES Cc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2ccc(Cl)cc2)c1C Show InChI InChI=1S/C22H25ClF2N2O/c1-15-4-3-5-19(16(15)2)21(28)26-14-20(17-6-8-18(23)9-7-17)27-12-10-22(24,25)11-13-27/h3-9,20H,10-14H2,1-2H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242027 (US9415055, 2,3-dichloro-N-[2-(6-chloro-3-pyridyl)-...) Show SMILES Clc1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C18H18Cl3N3O2/c19-14-3-1-2-13(17(14)21)18(25)23-11-15(24-6-8-26-9-7-24)12-4-5-16(20)22-10-12/h1-5,10,15H,6-9,11H2,(H,23,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.90	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242165 (US9415055, (+)2,3-dichloro-N-[2-[2-(difluoromethyl...) Show SMILES FC(F)c1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C18H18Cl2F2N4O2/c19-13-3-1-2-12(15(13)20)18(27)25-10-14(26-4-6-28-7-5-26)11-8-23-17(16(21)22)24-9-11/h1-3,8-9,14,16H,4-7,10H2,(H,25,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.90	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242042 (US9415055, 2-chloro-N-[2-(4,4-difluoro-1-piperidyl...) Show SMILES Fc1ccc(cn1)C(CNC(=O)c1ccccc1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H19ClF3N3O/c20-15-4-2-1-3-14(15)18(27)25-12-16(13-5-6-17(21)24-11-13)26-9-7-19(22,23)8-10-26/h1-6,11,16H,7-10,12H2,(H,25,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242094 (US9415055, (-)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES Fc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2cnc(nc2)C(F)(F)F)c1Cl Show InChI InChI=1S/C19H17ClF6N4O/c20-15-12(2-1-3-13(15)21)16(31)27-10-14(30-6-4-18(22,23)5-7-30)11-8-28-17(29-9-11)19(24,25)26/h1-3,8-9,14H,4-7,10H2,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242111 (US9415055, (+)2-chloro-N-[2-(4-chlorophenyl)-2-mor...) Show SMILES COc1cccc(C(=O)NCC(N2CCOCC2)c2ccc(Cl)cc2)c1Cl Show InChI InChI=1S/C20H22Cl2N2O3/c1-26-18-4-2-3-16(19(18)22)20(25)23-13-17(24-9-11-27-12-10-24)14-5-7-15(21)8-6-14/h2-8,17H,9-13H2,1H3,(H,23,25)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242217 (US9415055, (-)2,3-dichloro-N-[2-[6-(difluoromethyl...) Show SMILES FC(F)c1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C20H19Cl2F4N3O/c21-14-3-1-2-13(17(14)22)19(30)28-11-16(29-8-6-20(25,26)7-9-29)12-4-5-15(18(23)24)27-10-12/h1-5,10,16,18H,6-9,11H2,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.20	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242201 (US9415055, (+)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES COc1ccc(C(=O)NCC(N2CCC(F)(F)CC2)c2cnc(nc2)C(F)(F)F)c(Cl)c1 Show InChI InChI=1S/C20H20ClF5N4O2/c1-32-13-2-3-14(15(21)8-13)17(31)27-11-16(30-6-4-19(22,23)5-7-30)12-9-28-18(29-10-12)20(24,25)26/h2-3,8-10,16H,4-7,11H2,1H3,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.30	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242071 (US9415055, 2,3-dichloro-N-[2-(4,4-difluoro-1-piper...) Show SMILES Cc1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H20Cl2F2N4O/c1-12-24-9-13(10-25-12)16(27-7-5-19(22,23)6-8-27)11-26-18(28)14-3-2-4-15(20)17(14)21/h2-4,9-10,16H,5-8,11H2,1H3,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.30	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242183 (US9415055, (+)2,3-dichloro-N-[2-(2-cyclopropylpyri...) Show SMILES FC1(F)CCN(CC1)C(CNC(=O)c1cccc(Cl)c1Cl)c1cnc(nc1)C1CC1 Show InChI InChI=1S/C21H22Cl2F2N4O/c22-16-3-1-2-15(18(16)23)20(30)28-12-17(29-8-6-21(24,25)7-9-29)14-10-26-19(27-11-14)13-4-5-13/h1-3,10-11,13,17H,4-9,12H2,(H,28,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.30	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242025 (US9415055, 2,3-dichloro-N-[2-morpholino-2-[6-(trif...) Show SMILES FC(F)(F)c1ccc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C19H18Cl2F3N3O2/c20-14-3-1-2-13(17(14)21)18(28)26-11-15(27-6-8-29-9-7-27)12-4-5-16(25-10-12)19(22,23)24/h1-5,10,15H,6-9,11H2,(H,26,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.60	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242141 (US9415055, (+)2,6-dichloro-N-[2-(4,4-difluoro-1-pi...) Show SMILES FC(F)(F)c1ncc(cn1)C(CNC(=O)c1c(Cl)cccc1Cl)N1CCC(F)(F)CC1 Show InChI InChI=1S/C19H17Cl2F5N4O/c20-12-2-1-3-13(21)15(12)16(31)27-10-14(30-6-4-18(22,23)5-7-30)11-8-28-17(29-9-11)19(24,25)26/h1-3,8-9,14H,4-7,10H2,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.70	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242199 (US9415055, (+)2,4-dichloro-N-[2-(4,4-difluoro-1-pi...) Show SMILES Fc1cc(Cl)cc(Cl)c1C(=O)NCC(N1CCC(F)(F)CC1)c1cnc(nc1)C(F)(F)F Show InChI InChI=1S/C19H16Cl2F6N4O/c20-11-5-12(21)15(13(22)6-11)16(32)28-9-14(31-3-1-18(23,24)2-4-31)10-7-29-17(30-8-10)19(25,26)27/h5-8,14H,1-4,9H2,(H,28,32)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.70	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242124 (US9415055, (-)2,3-dichloro-N-[2-(4-fluoro-1-piperi...) Show SMILES FC1CCN(CC1)C(CNC(=O)c1cccc(Cl)c1Cl)c1cnc(nc1)C(F)(F)F Show InChI InChI=1S/C19H18Cl2F4N4O/c20-14-3-1-2-13(16(14)21)17(30)26-10-15(29-6-4-12(22)5-7-29)11-8-27-18(28-9-11)19(23,24)25/h1-3,8-9,12,15H,4-7,10H2,(H,26,30)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.70	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242035 (US9415055, (+)2,3-dichloro-N-[2-morpholino-2-[2-(t...) Show SMILES FC(F)(F)c1ncc(cn1)C(CNC(=O)c1cccc(Cl)c1Cl)N1CCOCC1 Show InChI InChI=1S/C18H17Cl2F3N4O2/c19-13-3-1-2-12(15(13)20)16(28)24-10-14(27-4-6-29-7-5-27)11-8-25-17(26-9-11)18(21,22)23/h1-3,8-9,14H,4-7,10H2,(H,24,28)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.80	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242138 (US9415055, (-)2-chloro-N-[2-(4,4-difluoro-1-piperi...) Show SMILES COc1cccc(C(=O)NCC(N2CCC(F)(F)CC2)c2cnc(nc2)C(F)(F)F)c1Cl Show InChI InChI=1S/C20H20ClF5N4O2/c1-32-15-4-2-3-13(16(15)21)17(31)27-11-14(30-7-5-19(22,23)6-8-30)12-9-28-18(29-10-12)20(24,25)26/h2-4,9-10,14H,5-8,11H2,1H3,(H,27,31)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.80	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair
P2X purinoceptor 7 (Homo sapiens (Human))	BDBM242167 (US9415055, (+)2-chloro-N-[2-[2-(difluoromethyl)pyr...) Show SMILES FC(F)c1ncc(cn1)C(CNC(=O)c1cccc(F)c1Cl)N1CCOCC1 Show InChI InChI=1S/C18H18ClF3N4O2/c19-15-12(2-1-3-13(15)20)18(27)25-10-14(26-4-6-28-7-5-26)11-8-23-17(16(21)22)24-9-11/h1-3,8-9,14,16H,4-7,10H2,(H,25,27)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.80	n/a	n/a	n/a	n/a	7.4	37
H. Lundbeck A/S US Patent					Assay Description Briefly, 293-human or mouse P2X7 stable cells were incubated in sucrose buffer, pH 7.4 [KCl (5 mM), NaH2PO42H2O (9.6 mM), HEPES (25 mM), sucrose (280...				US Patent US9415055 (2016) BindingDB Entry DOI: 10.7270/Q2NC604C
					More data for this Ligand-Target Pair

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