Compile Data Set for Download or QSAR

Found 90 hits with Last Name = 'hortala' and Initial = 'l'   

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
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323009 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-me...) Show SMILES Cn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCCCC1)C(N)=O Show InChI InChI=1S/C29H31Cl3N4O2/c1-34-25(27(37)35-15-11-29(12-16-35,28(33)38)36-13-3-2-4-14-36)18-23(22-10-9-21(31)17-24(22)32)26(34)19-5-7-20(30)8-6-19/h5-10,17-18H,2-4,11-16H2,1H3,(H2,33,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176622 (US9115121, 13) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O Show InChI InChI=1S/C21H22ClFN4O2/c1-21(2,28)16-12-14(6-9-17(16)22)18-25-19(27-20(26-18)29-3)24-11-10-13-4-7-15(23)8-5-13/h4-9,12,28H,10-11H2,1-3H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323003 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(2...) Show SMILES CS(=O)(=O)CCn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCCCC1)C(N)=O Show InChI InChI=1S/C31H35Cl3N4O4S/c1-43(41,42)18-17-38-27(29(39)36-15-11-31(12-16-36,30(35)40)37-13-3-2-4-14-37)20-25(24-10-9-23(33)19-26(24)34)28(38)21-5-7-22(32)8-6-21/h5-10,19-20H,2-4,11-18H2,1H3,(H2,35,40)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.400	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176622 (US9115121, 13) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O Show InChI InChI=1S/C21H22ClFN4O2/c1-21(2,28)16-12-14(6-9-17(16)22)18-25-19(27-20(26-18)29-3)24-11-10-13-4-7-15(23)8-5-13/h4-9,12,28H,10-11H2,1-3H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	0.580	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi R&D Curated by ChEMBL					Assay Description Binding affinity to human CB2 receptor				Bioorg Med Chem Lett 24: 283-7 (2014) Article DOI: 10.1016/j.bmcl.2013.11.023 BindingDB Entry DOI: 10.7270/Q2ZC85VD
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323007 (1-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-met...) Show SMILES Cn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(C(N)=O)c1ccccc1 Show InChI InChI=1S/C30H26Cl3N3O2/c1-35-26(28(37)36-15-13-30(14-16-36,29(34)38)20-5-3-2-4-6-20)18-24(23-12-11-22(32)17-25(23)33)27(35)19-7-9-21(31)10-8-19/h2-12,17-18H,13-16H2,1H3,(H2,34,38)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176668 (US9115121, 65) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(Cl)c(OCC(N)=O)c1 Show InChI InChI=1S/C20H19ClFN5O3/c1-29-20-26-18(13-4-7-15(21)16(10-13)30-11-17(23)28)25-19(27-20)24-9-8-12-2-5-14(22)6-3-12/h2-7,10H,8-9,11H2,1H3,(H2,23,28)(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323006 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(3...) Show SMILES CS(=O)(=O)NCCCn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCC(F)(F)CC1)C(N)=O Show InChI InChI=1S/C32H36Cl3F2N5O4S/c1-47(45,46)39-13-2-14-42-27(20-25(24-8-7-23(34)19-26(24)35)28(42)21-3-5-22(33)6-4-21)29(43)40-15-9-31(10-16-40,30(38)44)41-17-11-32(36,37)12-18-41/h3-8,19-20,39H,2,9-18H2,1H3,(H2,38,44)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176645 (US9115121, 37) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(F)c2cccnc12 Show InChI InChI=1S/C21H17F2N5O/c1-29-21-27-19(16-8-9-17(23)15-3-2-11-24-18(15)16)26-20(28-21)25-12-10-13-4-6-14(22)7-5-13/h2-9,11H,10,12H2,1H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176606 (US9115121, 58) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(OC)c(c1)C(C)(C)O Show InChI InChI=1S/C22H25FN4O3/c1-22(2,28)17-13-15(7-10-18(17)29-3)19-25-20(27-21(26-19)30-4)24-12-11-14-5-8-16(23)9-6-14/h5-10,13,28H,11-12H2,1-4H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176604 (US9115121, 46) Show SMILES COc1nc(NCCc2ccc(OC(F)F)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O Show InChI InChI=1S/C22H23ClF2N4O3/c1-22(2,30)16-12-14(6-9-17(16)23)18-27-20(29-21(28-18)31-3)26-11-10-13-4-7-15(8-5-13)32-19(24)25/h4-9,12,19,30H,10-11H2,1-3H3,(H,26,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.20	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50323006 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(3...) Show SMILES CS(=O)(=O)NCCCn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCC(F)(F)CC1)C(N)=O Show InChI InChI=1S/C32H36Cl3F2N5O4S/c1-47(45,46)39-13-2-14-42-27(20-25(24-8-7-23(34)19-26(24)35)28(42)21-3-5-22(33)6-4-21)29(43)40-15-9-31(10-16-40,30(38)44)41-17-11-32(36,37)12-18-41/h3-8,19-20,39H,2,9-18H2,1H3,(H2,38,44)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Inhibition of human recombinant CB1 receptor expressed in CHO cells				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323004 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(3...) Show SMILES CS(=O)(=O)NCCCn1c(cc(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)N1CCC(CC1)(N1CCCCC1)C(N)=O Show InChI InChI=1S/C32H38Cl3N5O4S/c1-45(43,44)37-14-5-17-40-28(30(41)38-18-12-32(13-19-38,31(36)42)39-15-3-2-4-16-39)21-26(25-11-10-24(34)20-27(25)35)29(40)22-6-8-23(33)9-7-22/h6-11,20-21,37H,2-5,12-19H2,1H3,(H2,36,42)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50494951 (CHEMBL3099054) Show SMILES CC(C)(O)c1cc(ccc1Cl)-c1nc(NCCc2ccc(F)cc2)nc(OCF)n1 Show InChI InChI=1S/C21H21ClF2N4O2/c1-21(2,29)16-11-14(5-8-17(16)22)18-26-19(28-20(27-18)30-12-23)25-10-9-13-3-6-15(24)7-4-13/h3-8,11,29H,9-10,12H2,1-2H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi R&D Curated by ChEMBL					Assay Description Binding affinity to human CB2 receptor expressed in CHO cells				Bioorg Med Chem Lett 24: 283-7 (2014) Article DOI: 10.1016/j.bmcl.2013.11.023 BindingDB Entry DOI: 10.7270/Q2ZC85VD
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM21278 (5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl...) Show SMILES Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 Show InChI InChI=1S/C22H21Cl3N4O/c1-14-20(22(30)27-28-11-3-2-4-12-28)26-29(19-10-9-17(24)13-18(19)25)21(14)15-5-7-16(23)8-6-15/h5-10,13H,2-4,11-12H2,1H3,(H,27,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176620 (US9115121, 11) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc(c1)S(=O)(=O)NC1CC1 Show InChI InChI=1S/C21H22FN5O3S/c1-30-21-25-19(15-3-2-4-18(13-15)31(28,29)27-17-9-10-17)24-20(26-21)23-12-11-14-5-7-16(22)8-6-14/h2-8,13,17,27H,9-12H2,1H3,(H,23,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176660 (US9115121, 53) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(Cl)c(c1)S(=O)(=O)N1CCOCC1 Show InChI InChI=1S/C22H23ClFN5O4S/c1-32-22-27-20(26-21(28-22)25-9-8-15-2-5-17(24)6-3-15)16-4-7-18(23)19(14-16)34(30,31)29-10-12-33-13-11-29/h2-7,14H,8-13H2,1H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176610 (US9115121, 69) Show SMILES COc1nc(NCCc2ccc(OCF)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O Show InChI InChI=1S/C22H24ClFN4O3/c1-22(2,29)17-12-15(6-9-18(17)23)19-26-20(28-21(27-19)30-3)25-11-10-14-4-7-16(8-5-14)31-13-24/h4-9,12,29H,10-11,13H2,1-3H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.90	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176656 (US9115121, 49) Show SMILES COc1nc(NCCc2ccc(OC(F)F)cc2)nc(n1)-c1cccc(OC)c1C(C)(C)O Show InChI InChI=1S/C23H26F2N4O4/c1-23(2,30)18-16(6-5-7-17(18)31-3)19-27-21(29-22(28-19)32-4)26-13-12-14-8-10-15(11-9-14)33-20(24)25/h5-11,20,30H,12-13H2,1-4H3,(H,26,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176654 (US9115121, 47) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cc2ccccc2s1 Show InChI InChI=1S/C20H17FN4OS/c1-26-20-24-18(17-12-14-4-2-3-5-16(14)27-17)23-19(25-20)22-11-10-13-6-8-15(21)9-7-13/h2-9,12H,10-11H2,1H3,(H,22,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176666 (US9115121, 62) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(Cl)c(c1)S(=O)(=O)NC1CC1 Show InChI InChI=1S/C21H21ClFN5O3S/c1-31-21-26-19(25-20(27-21)24-11-10-13-2-5-15(23)6-3-13)14-4-9-17(22)18(12-14)32(29,30)28-16-7-8-16/h2-6,9,12,16,28H,7-8,10-11H2,1H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323005 (1'-(5-(4-chlorophenyl)-4-(2,4-dichlorophenyl)-1-(3...) Show SMILES CC1(C)CCN(CC1)C1(CCN(CC1)C(=O)c1cc(c(-c2ccc(Cl)cc2)n1CCCNS(C)(=O)=O)-c1ccc(Cl)cc1Cl)C(N)=O Show InChI InChI=1S/C34H42Cl3N5O4S/c1-33(2)11-19-41(20-12-33)34(32(38)44)13-17-40(18-14-34)31(43)29-22-27(26-10-9-25(36)21-28(26)37)30(23-5-7-24(35)8-6-23)42(29)16-4-15-39-47(3,45)46/h5-10,21-22,39H,4,11-20H2,1-3H3,(H2,38,44)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL 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
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176638 (US9115121, 30) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cc2ccccc2o1 Show InChI InChI=1S/C20H17FN4O2/c1-26-20-24-18(17-12-14-4-2-3-5-16(14)27-17)23-19(25-20)22-11-10-13-6-8-15(21)9-7-13/h2-9,12H,10-11H2,1H3,(H,22,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176602 (US9115121, 18) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cc2c(Cl)cccc2[nH]1 Show InChI InChI=1S/C20H17ClFN5O/c1-28-20-26-18(17-11-14-15(21)3-2-4-16(14)24-17)25-19(27-20)23-10-9-12-5-7-13(22)8-6-12/h2-8,11,24H,9-10H2,1H3,(H,23,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176623 (US9115121, 14) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(F)c(c1)C(C)(C)O Show InChI InChI=1S/C21H22F2N4O2/c1-21(2,28)16-12-14(6-9-17(16)23)18-25-19(27-20(26-18)29-3)24-11-10-13-4-7-15(22)8-5-13/h4-9,12,28H,10-11H2,1-3H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Rattus norvegicus (rat))	BDBM50323010 (1'-(5-(4-chlorophenyl)-1-(2-cyanoethyl)-4-(2,4-dic...) Show SMILES NC(=O)C1(CCN(CC1)C(=O)c1cc(c(-c2ccc(Cl)cc2)n1CCC#N)-c1ccc(Cl)cc1Cl)N1CCCCC1 Show InChI InChI=1S/C31H32Cl3N5O2/c32-22-7-5-21(6-8-22)28-25(24-10-9-23(33)19-26(24)34)20-27(39(28)16-4-13-35)29(40)37-17-11-31(12-18-37,30(36)41)38-14-2-1-3-15-38/h5-10,19-20H,1-4,11-12,14-18H2,(H2,36,41)	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi-aventis R&D Curated by ChEMBL					Assay Description Binding affinity to CB1 receptor in rat brain synaptosomal membranes				Bioorg Med Chem Lett 20: 4573-7 (2010) Article DOI: 10.1016/j.bmcl.2010.06.017 BindingDB Entry DOI: 10.7270/Q28G8KV6
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176671 (US9115121, 70) Show SMILES COc1nc(NCCc2ccc(OCF)cc2)nc(n1)-c1ccc(OC)c(c1)C(C)(C)O Show InChI InChI=1S/C23H27FN4O4/c1-23(2,29)18-13-16(7-10-19(18)30-3)20-26-21(28-22(27-20)31-4)25-12-11-15-5-8-17(9-6-15)32-14-24/h5-10,13,29H,11-12,14H2,1-4H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176616 (US9115121, 7) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc2OCOc2c1 Show InChI InChI=1S/C19H17FN4O3/c1-25-19-23-17(13-4-7-15-16(10-13)27-11-26-15)22-18(24-19)21-9-8-12-2-5-14(20)6-3-12/h2-7,10H,8-9,11H2,1H3,(H,21,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176661 (US9115121, 54) Show SMILES COc1nc(NCCc2ccc(OC(F)(F)F)cc2)nc(n1)-c1ccc(OC)c(c1)C(C)(C)O Show InChI InChI=1S/C23H25F3N4O4/c1-22(2,31)17-13-15(7-10-18(17)32-3)19-28-20(30-21(29-19)33-4)27-12-11-14-5-8-16(9-6-14)34-23(24,25)26/h5-10,13,31H,11-12H2,1-4H3,(H,27,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176605 (US9115121, 56) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc(c1)C(C)(C)O Show InChI InChI=1S/C21H23FN4O2/c1-21(2,27)16-6-4-5-15(13-16)18-24-19(26-20(25-18)28-3)23-12-11-14-7-9-17(22)10-8-14/h4-10,13,27H,11-12H2,1-3H3,(H,23,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176619 (US9115121, 10) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc(C(C)=O)c1F Show InChI InChI=1S/C20H18F2N4O2/c1-12(27)15-4-3-5-16(17(15)22)18-24-19(26-20(25-18)28-2)23-11-10-13-6-8-14(21)9-7-13/h3-9H,10-11H2,1-2H3,(H,23,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176608 (US9115121, 63) Show SMILES CCOC(=O)COc1cc(ccc1Cl)-c1nc(NCCc2ccc(F)cc2)nc(OC)n1 Show InChI InChI=1S/C22H22ClFN4O4/c1-3-31-19(29)13-32-18-12-15(6-9-17(18)23)20-26-21(28-22(27-20)30-2)25-11-10-14-4-7-16(24)8-5-14/h4-9,12H,3,10-11,13H2,1-2H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176670 (US9115121, 68) Show SMILES COc1nc(NCCc2ccc(OC(F)F)cc2)nc(n1)-c1ccc(Cl)c(OCC(N)=O)c1 Show InChI InChI=1S/C21H20ClF2N5O4/c1-31-21-28-18(13-4-7-15(22)16(10-13)32-11-17(25)30)27-20(29-21)26-9-8-12-2-5-14(6-3-12)33-19(23)24/h2-7,10,19H,8-9,11H2,1H3,(H2,25,30)(H,26,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176612 (US9115121, 3) Show SMILES COc1ccc(cc1OC)-c1nc(NCCc2ccc(F)cc2)nc(OC)n1 Show InChI InChI=1S/C20H21FN4O3/c1-26-16-9-6-14(12-17(16)27-2)18-23-19(25-20(24-18)28-3)22-11-10-13-4-7-15(21)8-5-13/h4-9,12H,10-11H2,1-3H3,(H,22,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176641 (US9115121, 33) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccnc2ccccc12 Show InChI InChI=1S/C21H18FN5O/c1-28-21-26-19(17-11-13-23-18-5-3-2-4-16(17)18)25-20(27-21)24-12-10-14-6-8-15(22)9-7-14/h2-9,11,13H,10,12H2,1H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176603 (US9115121, 20) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cc2cc(F)ccc2[nH]1 Show InChI InChI=1S/C20H17F2N5O/c1-28-20-26-18(17-11-13-10-15(22)6-7-16(13)24-17)25-19(27-20)23-9-8-12-2-4-14(21)5-3-12/h2-7,10-11,24H,8-9H2,1H3,(H,23,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176655 (US9115121, 48) Show SMILES COc1ccc2oc(cc2c1)-c1nc(NCCc2ccc(F)cc2)nc(OC)n1 Show InChI InChI=1S/C21H19FN4O3/c1-27-16-7-8-17-14(11-16)12-18(29-17)19-24-20(26-21(25-19)28-2)23-10-9-13-3-5-15(22)6-4-13/h3-8,11-12H,9-10H2,1-2H3,(H,23,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176615 (US9115121, 6) Show SMILES COC(=O)CCc1cccc(c1)-c1nc(NCCc2ccc(F)cc2)nc(OC)n1 Show InChI InChI=1S/C22H23FN4O3/c1-29-19(28)11-8-16-4-3-5-17(14-16)20-25-21(27-22(26-20)30-2)24-13-12-15-6-9-18(23)10-7-15/h3-7,9-10,14H,8,11-13H2,1-2H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176601 (US9115121, 12) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(OC)c(c1)S(=O)(=O)NC1CC1 Show InChI InChI=1S/C22H24FN5O4S/c1-31-18-10-5-15(13-19(18)33(29,30)28-17-8-9-17)20-25-21(27-22(26-20)32-2)24-12-11-14-3-6-16(23)7-4-14/h3-7,10,13,17,28H,8-9,11-12H2,1-2H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176657 (US9115121, 50) Show SMILES COc1nc(NCCc2ccc(OC(F)(F)F)cc2)nc(n1)-c1ccc(Cl)c(c1)C(C)(C)O Show InChI InChI=1S/C22H22ClF3N4O3/c1-21(2,31)16-12-14(6-9-17(16)23)18-28-19(30-20(29-18)32-3)27-11-10-13-4-7-15(8-5-13)33-22(24,25)26/h4-9,12,31H,10-11H2,1-3H3,(H,27,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176614 (US9115121, 5) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(SC)cc1 Show InChI InChI=1S/C19H19FN4OS/c1-25-19-23-17(14-5-9-16(26-2)10-6-14)22-18(24-19)21-12-11-13-3-7-15(20)8-4-13/h3-10H,11-12H2,1-2H3,(H,21,22,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176628 (US9115121, 19) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cc2cc(Cl)ccc2[nH]1 Show InChI InChI=1S/C20H17ClFN5O/c1-28-20-26-18(17-11-13-10-14(21)4-7-16(13)24-17)25-19(27-20)23-9-8-12-2-5-15(22)6-3-12/h2-7,10-11,24H,8-9H2,1H3,(H,23,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176637 (US9115121, 29) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc2cc[nH]c2c1 Show InChI InChI=1S/C20H18FN5O/c1-27-20-25-18(15-5-4-14-9-11-22-17(14)12-15)24-19(26-20)23-10-8-13-2-6-16(21)7-3-13/h2-7,9,11-12,22H,8,10H2,1H3,(H,23,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176617 (US9115121, 8) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc2OCCOc2c1 Show InChI InChI=1S/C20H19FN4O3/c1-26-20-24-18(14-4-7-16-17(12-14)28-11-10-27-16)23-19(25-20)22-9-8-13-2-5-15(21)6-3-13/h2-7,12H,8-11H2,1H3,(H,22,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176644 (US9115121, 36) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc2cccnc12 Show InChI InChI=1S/C21H18FN5O/c1-28-21-26-19(17-6-2-4-15-5-3-12-23-18(15)17)25-20(27-21)24-13-11-14-7-9-16(22)10-8-14/h2-10,12H,11,13H2,1H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176624 (US9115121, 15) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(c(OC)c1)C(C)(C)O Show InChI InChI=1S/C22H25FN4O3/c1-22(2,28)17-10-7-15(13-18(17)29-3)19-25-20(27-21(26-19)30-4)24-12-11-14-5-8-16(23)9-6-14/h5-10,13,28H,11-12H2,1-4H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176626 (US9115121, 17) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cc2cc(Br)ccc2[nH]1 Show InChI InChI=1S/C20H17BrFN5O/c1-28-20-26-18(17-11-13-10-14(21)4-7-16(13)24-17)25-19(27-20)23-9-8-12-2-5-15(22)6-3-12/h2-7,10-11,24H,8-9H2,1H3,(H,23,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176652 (US9115121, 44) Show SMILES COc1nc(NCCc2ccc(OC(F)F)cc2)nc(n1)-c1cccc(c1)C(C)(C)O Show InChI InChI=1S/C22H24F2N4O3/c1-22(2,29)16-6-4-5-15(13-16)18-26-20(28-21(27-18)30-3)25-12-11-14-7-9-17(10-8-14)31-19(23)24/h4-10,13,19,29H,11-12H2,1-3H3,(H,25,26,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank 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
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176669 (US9115121, 66) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(Cl)c(OCCCNS(C)(=O)=O)c1 Show InChI InChI=1S/C22H25ClFN5O4S/c1-32-22-28-20(27-21(29-22)25-12-10-15-4-7-17(24)8-5-15)16-6-9-18(23)19(14-16)33-13-3-11-26-34(2,30)31/h4-9,14,26H,3,10-13H2,1-2H3,(H,25,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank 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
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176667 (US9115121, 64) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1ccc(OC)c(c1)C#N Show InChI InChI=1S/C20H18FN5O2/c1-27-17-8-5-14(11-15(17)12-22)18-24-19(26-20(25-18)28-2)23-10-9-13-3-6-16(21)7-4-13/h3-8,11H,9-10H2,1-2H3,(H,23,24,25,26)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM176649 (US9115121, 41) Show SMILES COc1nc(NCCc2ccc(F)cc2)nc(n1)-c1cccc2cnccc12 Show InChI InChI=1S/C21H18FN5O/c1-28-21-26-19(18-4-2-3-15-13-23-11-10-17(15)18)25-20(27-21)24-12-9-14-5-7-16(22)8-6-14/h2-8,10-11,13H,9,12H2,1H3,(H,24,25,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Sanofi US Patent					Assay Description Affinity binding tests were performed according to the experimental conditions described by M. Rinaldi-Carmona in J. Pharmacol. Exp. Therap. 1998, 28...				US Patent US9115121 (2015) BindingDB Entry DOI: 10.7270/Q23N225X
					More data for this Ligand-Target Pair

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