Compile Data Set for Download or QSAR

Found 52 hits Enz. Inhib. hit(s) with all data for entry = 50007504   

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 2 (Homo sapiens (Human))	BDBM50510004 (CHEMBL4541878) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(63.76,-29.3,;62.43,-30.08,;61.1,-29.31,;59.77,-30.09,;58.43,-29.33,;57.1,-30.11,;55.76,-29.34,;54.43,-30.12,;54.44,-31.66,;53.11,-32.44,;53.08,-30.53,;52.17,-31.78,;53.17,-33.99,;51.83,-34.74,;50.5,-35.52,;49.16,-34.75,;49.17,-33.2,;50.49,-32.43,;51.83,-33.19,;54.66,-34.4,;56,-35.17,;57.33,-34.39,;57.33,-32.84,;55.99,-32.08,;54.66,-32.85,;50.71,-31.3,;49.46,-32.21,;50.71,-29.76,;52.17,-29.29,;52.65,-27.82,)| Show InChI InChI=1S/C26H29NO3/c1-2-3-4-5-10-15-30-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(29)27-24(22)28/h6-9,11-14,21-23H,2-5,10,15-16H2,1H3,(H,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	230	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510006 (CHEMBL4448334) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(19.27,-16.24,;20.61,-17.01,;21.94,-16.24,;23.28,-17.01,;24.61,-16.24,;25.94,-17.01,;27.28,-16.24,;28.61,-17.01,;28.61,-18.55,;27.36,-19.45,;30.07,-19.02,;30.98,-17.78,;30.07,-16.53,;30.55,-15.07,;31.01,-19.68,;32.34,-18.91,;29.73,-20.44,;28.4,-19.68,;27.07,-20.45,;27.07,-21.99,;28.4,-22.76,;29.74,-21.99,;31.07,-21.23,;32.57,-21.64,;33.9,-22.41,;35.24,-21.64,;35.23,-20.09,;33.9,-19.33,;32.57,-20.1,)| Show InChI InChI=1S/C26H29NO2/c1-3-4-5-6-11-16-27-24(28)22-21-17-12-7-9-14-19(17)26(2,23(22)25(27)29)20-15-10-8-13-18(20)21/h7-10,12-15,21-23H,3-6,11,16H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	980	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510005 (CHEMBL4461463) Show SMILES CCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:26:27:9.10:20.15,7:9:20.15:27.22,11:10:20.15:27.22,16:15:9.10:27.22,THB:23:22:9.10:20.15,(39.21,-16.91,;40.55,-16.14,;41.88,-16.91,;43.21,-16.14,;44.55,-16.91,;45.88,-16.14,;47.22,-16.91,;47.21,-18.45,;45.97,-19.35,;48.68,-18.92,;49.58,-17.68,;48.68,-16.43,;49.16,-14.97,;49.62,-19.58,;50.95,-18.81,;48.34,-20.34,;47,-19.58,;45.67,-20.35,;45.67,-21.89,;47.01,-22.66,;48.34,-21.89,;49.67,-21.13,;51.17,-21.54,;52.51,-22.31,;53.84,-21.54,;53.84,-19.99,;52.5,-19.23,;51.17,-20,)| Show InChI InChI=1S/C25H27NO2/c1-3-4-5-10-15-26-23(27)21-20-16-11-6-8-13-18(16)25(2,22(21)24(26)28)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,3-5,10,15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510009 (CHEMBL4586739) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(44.93,-29.24,;43.6,-30.02,;42.27,-29.26,;40.94,-30.04,;39.6,-29.27,;38.27,-30.05,;36.93,-29.29,;35.6,-30.07,;35.61,-31.61,;34.28,-32.38,;34.25,-30.48,;33.34,-31.72,;34.34,-33.93,;33.01,-34.69,;31.67,-35.46,;30.33,-34.69,;30.34,-33.15,;31.66,-32.38,;33,-33.14,;35.83,-34.34,;37.17,-35.11,;38.5,-34.34,;38.5,-32.79,;37.16,-32.03,;35.83,-32.8,;31.88,-31.25,;30.63,-32.15,;31.88,-29.71,;33.34,-29.23,;33.82,-27.77,)| Show InChI InChI=1S/C26H30N2O2/c1-2-3-4-5-10-15-27-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(30)28-24(22)29/h6-9,11-14,21-23,27H,2-5,10,15-16H2,1H3,(H,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.01E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.74E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510007 (CHEMBL4457335) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:24:25:10.11:18.13,8:10:18.13:25.20,26:11:18.13:25.20,14:13:10.11:25.20,THB:21:20:10.11:18.13,(31.74,-4.5,;33.07,-5.27,;34.4,-4.5,;35.74,-5.27,;37.07,-4.5,;38.4,-5.27,;39.74,-4.5,;41.07,-5.27,;41.07,-6.81,;39.82,-7.72,;42.54,-7.29,;43.44,-6.04,;43.48,-7.95,;42.19,-8.7,;40.86,-7.94,;39.53,-8.71,;39.53,-10.26,;40.86,-11.03,;42.2,-10.25,;43.53,-9.5,;45.03,-9.91,;46.36,-10.68,;47.7,-9.9,;47.69,-8.35,;46.36,-7.59,;45.03,-8.36,;42.54,-4.8,;43.01,-3.33,)| Show InChI InChI=1S/C25H27NO2/c1-2-3-4-5-10-15-26-24(27)22-20-16-11-6-7-12-17(16)21(23(22)25(26)28)19-14-9-8-13-18(19)20/h6-9,11-14,20-23H,2-5,10,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.01E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510002 (CHEMBL4585014) Show SMILES CCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:23:24:9.10:17.12,7:9:17.12:24.19,25:10:17.12:24.19,13:12:9.10:24.19,THB:20:19:9.10:17.12| Show InChI InChI=1S/C24H25NO2/c1-2-3-4-9-14-25-23(26)21-19-15-10-5-6-11-16(15)20(22(21)24(25)27)18-13-8-7-12-17(18)19/h5-8,10-13,19-22H,2-4,9,14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.06E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510013 (CHEMBL4443830) Show SMILES CCCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:25:26:11.12:19.14,9:11:19.14:26.21,27:12:19.14:26.21,15:14:11.12:26.21,THB:22:21:11.12:19.14,(50.22,-4.88,;51.56,-4.11,;52.89,-4.88,;54.23,-4.11,;55.56,-4.88,;56.89,-4.11,;58.23,-4.88,;59.56,-4.11,;60.89,-4.88,;60.89,-6.42,;59.65,-7.33,;62.36,-6.9,;63.26,-5.65,;63.3,-7.56,;62.02,-8.31,;60.68,-7.55,;59.35,-8.32,;59.35,-9.87,;60.69,-10.64,;62.02,-9.87,;63.35,-9.11,;64.85,-9.52,;66.18,-10.29,;67.52,-9.51,;67.52,-7.96,;66.18,-7.2,;64.85,-7.97,;62.36,-4.41,;62.83,-2.94,)| Show InChI InChI=1S/C26H29NO2/c1-2-3-4-5-6-11-16-27-25(28)23-21-17-12-7-8-13-18(17)22(24(23)26(27)29)20-15-10-9-14-19(20)21/h7-10,12-15,21-24H,2-6,11,16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.22E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510003 (CHEMBL4586819) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Cl)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(2.19,-16.02,;3.52,-16.79,;4.86,-16.02,;6.19,-16.79,;7.52,-16.02,;8.86,-16.79,;10.19,-16.02,;11.52,-16.79,;11.52,-18.33,;10.28,-19.24,;12.99,-18.81,;13.89,-17.56,;12.99,-16.31,;13.46,-14.85,;13.93,-19.47,;15.26,-18.69,;12.65,-20.22,;11.31,-19.46,;9.98,-20.23,;9.98,-21.77,;11.32,-22.54,;12.65,-21.77,;13.98,-21.01,;15.48,-21.42,;16.81,-22.19,;18.15,-21.42,;18.15,-19.87,;16.81,-19.11,;15.48,-19.88,)| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510007 (CHEMBL4457335) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:24:25:10.11:18.13,8:10:18.13:25.20,26:11:18.13:25.20,14:13:10.11:25.20,THB:21:20:10.11:18.13,(31.74,-4.5,;33.07,-5.27,;34.4,-4.5,;35.74,-5.27,;37.07,-4.5,;38.4,-5.27,;39.74,-4.5,;41.07,-5.27,;41.07,-6.81,;39.82,-7.72,;42.54,-7.29,;43.44,-6.04,;43.48,-7.95,;42.19,-8.7,;40.86,-7.94,;39.53,-8.71,;39.53,-10.26,;40.86,-11.03,;42.2,-10.25,;43.53,-9.5,;45.03,-9.91,;46.36,-10.68,;47.7,-9.9,;47.69,-8.35,;46.36,-7.59,;45.03,-8.36,;42.54,-4.8,;43.01,-3.33,)| Show InChI InChI=1S/C25H27NO2/c1-2-3-4-5-10-15-26-24(27)22-20-16-11-6-7-12-17(16)21(23(22)25(26)28)19-14-9-8-13-18(19)20/h6-9,11-14,20-23H,2-5,10,15H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.77E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510008 (CHEMBL504005) Show SMILES O=C1NC(=O)C2C1C1c3ccccc3C2c2ccccc12 |TLB:9:8:20.15:6.5,19:20:8.13:6.5,THB:3:5:8.13:20.15,12:13:20.15:6.5,1:6:8.13:20.15,16:15:8.13:6.5,(-.27,-6.77,;-.12,-8.3,;1.2,-9.07,;.86,-10.58,;1.89,-11.73,;-.66,-10.72,;-1.28,-9.31,;-1.89,-11.58,;-3.23,-12.35,;-4.56,-11.59,;-5.88,-12.36,;-5.89,-13.91,;-4.55,-14.67,;-3.22,-13.91,;-1.9,-14.68,;-.55,-13.91,;.78,-14.67,;2.12,-13.91,;2.11,-12.35,;.78,-11.59,;-.54,-12.36,)| Show InChI InChI=1S/C18H13NO2/c20-17-15-13-9-5-1-2-6-10(9)14(16(15)18(21)19-17)12-8-4-3-7-11(12)13/h1-8,13-16H,(H,19,20,21)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510001 (CHEMBL4476184) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Br)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(69.39,-4.76,;70.72,-5.53,;72.05,-4.76,;73.39,-5.53,;74.72,-4.76,;76.05,-5.53,;77.39,-4.76,;78.72,-5.53,;78.72,-7.07,;77.48,-7.97,;80.19,-7.54,;81.09,-6.3,;80.19,-5.05,;80.66,-3.59,;81.13,-8.21,;82.46,-7.43,;79.85,-8.96,;78.51,-8.2,;77.18,-8.97,;77.18,-10.51,;78.51,-11.28,;79.85,-10.51,;81.18,-9.75,;82.68,-10.16,;84.01,-10.93,;85.35,-10.16,;85.34,-8.61,;84.01,-7.85,;82.68,-8.62,)| Show InChI InChI=1S/C25H26BrNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510003 (CHEMBL4586819) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Cl)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(2.19,-16.02,;3.52,-16.79,;4.86,-16.02,;6.19,-16.79,;7.52,-16.02,;8.86,-16.79,;10.19,-16.02,;11.52,-16.79,;11.52,-18.33,;10.28,-19.24,;12.99,-18.81,;13.89,-17.56,;12.99,-16.31,;13.46,-14.85,;13.93,-19.47,;15.26,-18.69,;12.65,-20.22,;11.31,-19.46,;9.98,-20.23,;9.98,-21.77,;11.32,-22.54,;12.65,-21.77,;13.98,-21.01,;15.48,-21.42,;16.81,-22.19,;18.15,-21.42,;18.15,-19.87,;16.81,-19.11,;15.48,-19.88,)| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510006 (CHEMBL4448334) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(19.27,-16.24,;20.61,-17.01,;21.94,-16.24,;23.28,-17.01,;24.61,-16.24,;25.94,-17.01,;27.28,-16.24,;28.61,-17.01,;28.61,-18.55,;27.36,-19.45,;30.07,-19.02,;30.98,-17.78,;30.07,-16.53,;30.55,-15.07,;31.01,-19.68,;32.34,-18.91,;29.73,-20.44,;28.4,-19.68,;27.07,-20.45,;27.07,-21.99,;28.4,-22.76,;29.74,-21.99,;31.07,-21.23,;32.57,-21.64,;33.9,-22.41,;35.24,-21.64,;35.23,-20.09,;33.9,-19.33,;32.57,-20.1,)| Show InChI InChI=1S/C26H29NO2/c1-3-4-5-6-11-16-27-24(28)22-21-17-12-7-9-14-19(17)26(2,23(22)25(27)29)20-15-10-8-13-18(20)21/h7-10,12-15,21-23H,3-6,11,16H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510004 (CHEMBL4541878) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(63.76,-29.3,;62.43,-30.08,;61.1,-29.31,;59.77,-30.09,;58.43,-29.33,;57.1,-30.11,;55.76,-29.34,;54.43,-30.12,;54.44,-31.66,;53.11,-32.44,;53.08,-30.53,;52.17,-31.78,;53.17,-33.99,;51.83,-34.74,;50.5,-35.52,;49.16,-34.75,;49.17,-33.2,;50.49,-32.43,;51.83,-33.19,;54.66,-34.4,;56,-35.17,;57.33,-34.39,;57.33,-32.84,;55.99,-32.08,;54.66,-32.85,;50.71,-31.3,;49.46,-32.21,;50.71,-29.76,;52.17,-29.29,;52.65,-27.82,)| Show InChI InChI=1S/C26H29NO3/c1-2-3-4-5-10-15-30-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(29)27-24(22)28/h6-9,11-14,21-23H,2-5,10,15-16H2,1H3,(H,27,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510001 (CHEMBL4476184) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Br)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(69.39,-4.76,;70.72,-5.53,;72.05,-4.76,;73.39,-5.53,;74.72,-4.76,;76.05,-5.53,;77.39,-4.76,;78.72,-5.53,;78.72,-7.07,;77.48,-7.97,;80.19,-7.54,;81.09,-6.3,;80.19,-5.05,;80.66,-3.59,;81.13,-8.21,;82.46,-7.43,;79.85,-8.96,;78.51,-8.2,;77.18,-8.97,;77.18,-10.51,;78.51,-11.28,;79.85,-10.51,;81.18,-9.75,;82.68,-10.16,;84.01,-10.93,;85.35,-10.16,;85.34,-8.61,;84.01,-7.85,;82.68,-8.62,)| Show InChI InChI=1S/C25H26BrNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510002 (CHEMBL4585014) Show SMILES CCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:23:24:9.10:17.12,7:9:17.12:24.19,25:10:17.12:24.19,13:12:9.10:24.19,THB:20:19:9.10:17.12| Show InChI InChI=1S/C24H25NO2/c1-2-3-4-9-14-25-23(26)21-19-15-10-5-6-11-16(15)20(22(21)24(25)27)18-13-8-7-12-17(18)19/h5-8,10-13,19-22H,2-4,9,14H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510011 (CHEMBL4458260) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18| Show InChI InChI=1S/C33H44N2O2/c1-3-5-7-9-15-21-34-23-33-26-19-13-11-17-24(26)28(25-18-12-14-20-27(25)33)29-30(33)32(37)35(31(29)36)22-16-10-8-6-4-2/h11-14,17-20,28-30,34H,3-10,15-16,21-23H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510008 (CHEMBL504005) Show SMILES O=C1NC(=O)C2C1C1c3ccccc3C2c2ccccc12 |TLB:9:8:20.15:6.5,19:20:8.13:6.5,THB:3:5:8.13:20.15,12:13:20.15:6.5,1:6:8.13:20.15,16:15:8.13:6.5,(-.27,-6.77,;-.12,-8.3,;1.2,-9.07,;.86,-10.58,;1.89,-11.73,;-.66,-10.72,;-1.28,-9.31,;-1.89,-11.58,;-3.23,-12.35,;-4.56,-11.59,;-5.88,-12.36,;-5.89,-13.91,;-4.55,-14.67,;-3.22,-13.91,;-1.9,-14.68,;-.55,-13.91,;.78,-14.67,;2.12,-13.91,;2.11,-12.35,;.78,-11.59,;-.54,-12.36,)| Show InChI InChI=1S/C18H13NO2/c20-17-15-13-9-5-1-2-6-10(9)14(16(15)18(21)19-17)12-8-4-3-7-11(12)13/h1-8,13-16H,(H,19,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510009 (CHEMBL4586739) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(44.93,-29.24,;43.6,-30.02,;42.27,-29.26,;40.94,-30.04,;39.6,-29.27,;38.27,-30.05,;36.93,-29.29,;35.6,-30.07,;35.61,-31.61,;34.28,-32.38,;34.25,-30.48,;33.34,-31.72,;34.34,-33.93,;33.01,-34.69,;31.67,-35.46,;30.33,-34.69,;30.34,-33.15,;31.66,-32.38,;33,-33.14,;35.83,-34.34,;37.17,-35.11,;38.5,-34.34,;38.5,-32.79,;37.16,-32.03,;35.83,-32.8,;31.88,-31.25,;30.63,-32.15,;31.88,-29.71,;33.34,-29.23,;33.82,-27.77,)| Show InChI InChI=1S/C26H30N2O2/c1-2-3-4-5-10-15-27-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(30)28-24(22)29/h6-9,11-14,21-23,27H,2-5,10,15-16H2,1H3,(H,28,29,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510013 (CHEMBL4443830) Show SMILES CCCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:25:26:11.12:19.14,9:11:19.14:26.21,27:12:19.14:26.21,15:14:11.12:26.21,THB:22:21:11.12:19.14,(50.22,-4.88,;51.56,-4.11,;52.89,-4.88,;54.23,-4.11,;55.56,-4.88,;56.89,-4.11,;58.23,-4.88,;59.56,-4.11,;60.89,-4.88,;60.89,-6.42,;59.65,-7.33,;62.36,-6.9,;63.26,-5.65,;63.3,-7.56,;62.02,-8.31,;60.68,-7.55,;59.35,-8.32,;59.35,-9.87,;60.69,-10.64,;62.02,-9.87,;63.35,-9.11,;64.85,-9.52,;66.18,-10.29,;67.52,-9.51,;67.52,-7.96,;66.18,-7.2,;64.85,-7.97,;62.36,-4.41,;62.83,-2.94,)| Show InChI InChI=1S/C26H29NO2/c1-2-3-4-5-6-11-16-27-25(28)23-21-17-12-7-8-13-18(17)22(24(23)26(27)29)20-15-10-9-14-19(20)21/h7-10,12-15,21-24H,2-6,11,16H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510005 (CHEMBL4461463) Show SMILES CCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:26:27:9.10:20.15,7:9:20.15:27.22,11:10:20.15:27.22,16:15:9.10:27.22,THB:23:22:9.10:20.15,(39.21,-16.91,;40.55,-16.14,;41.88,-16.91,;43.21,-16.14,;44.55,-16.91,;45.88,-16.14,;47.22,-16.91,;47.21,-18.45,;45.97,-19.35,;48.68,-18.92,;49.58,-17.68,;48.68,-16.43,;49.16,-14.97,;49.62,-19.58,;50.95,-18.81,;48.34,-20.34,;47,-19.58,;45.67,-20.35,;45.67,-21.89,;47.01,-22.66,;48.34,-21.89,;49.67,-21.13,;51.17,-21.54,;52.51,-22.31,;53.84,-21.54,;53.84,-19.99,;52.5,-19.23,;51.17,-20,)| Show InChI InChI=1S/C25H27NO2/c1-3-4-5-10-15-26-23(27)21-20-16-11-6-8-13-18(16)25(2,22(21)24(26)28)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,3-5,10,15H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510011 (CHEMBL4458260) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18| Show InChI InChI=1S/C33H44N2O2/c1-3-5-7-9-15-21-34-23-33-26-19-13-11-17-24(26)28(25-18-12-14-20-27(25)33)29-30(33)32(37)35(31(29)36)22-16-10-8-6-4-2/h11-14,17-20,28-30,34H,3-10,15-16,21-23H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510010 (CHEMBL4569234) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(26.01,-29.39,;24.68,-30.16,;23.35,-29.4,;22.02,-30.18,;20.68,-29.42,;19.35,-30.19,;18.01,-29.43,;16.68,-30.21,;16.69,-31.75,;15.36,-32.53,;15.33,-30.62,;14.42,-31.87,;15.42,-34.07,;14.08,-34.83,;12.75,-35.6,;11.41,-34.83,;11.42,-33.29,;12.74,-32.52,;14.08,-33.28,;16.91,-34.48,;18.25,-35.25,;19.58,-34.48,;19.58,-32.93,;18.24,-32.17,;16.91,-32.94,;12.96,-31.39,;11.71,-32.29,;12.96,-29.85,;11.62,-29.08,;10.29,-29.85,;8.95,-29.08,;7.62,-29.85,;6.29,-29.08,;4.95,-29.85,;3.62,-29.08,;14.42,-29.37,;14.9,-27.91,)| Show InChI InChI=1S/C33H43NO3/c1-3-5-7-9-15-21-34-31(35)29-28-24-17-11-13-19-26(24)33(30(29)32(34)36,27-20-14-12-18-25(27)28)23-37-22-16-10-8-6-4-2/h11-14,17-20,28-30H,3-10,15-16,21-23H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510010 (CHEMBL4569234) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(26.01,-29.39,;24.68,-30.16,;23.35,-29.4,;22.02,-30.18,;20.68,-29.42,;19.35,-30.19,;18.01,-29.43,;16.68,-30.21,;16.69,-31.75,;15.36,-32.53,;15.33,-30.62,;14.42,-31.87,;15.42,-34.07,;14.08,-34.83,;12.75,-35.6,;11.41,-34.83,;11.42,-33.29,;12.74,-32.52,;14.08,-33.28,;16.91,-34.48,;18.25,-35.25,;19.58,-34.48,;19.58,-32.93,;18.24,-32.17,;16.91,-32.94,;12.96,-31.39,;11.71,-32.29,;12.96,-29.85,;11.62,-29.08,;10.29,-29.85,;8.95,-29.08,;7.62,-29.85,;6.29,-29.08,;4.95,-29.85,;3.62,-29.08,;14.42,-29.37,;14.9,-27.91,)| Show InChI InChI=1S/C33H43NO3/c1-3-5-7-9-15-21-34-31(35)29-28-24-17-11-13-19-26(24)33(30(29)32(34)36,27-20-14-12-18-25(27)28)23-37-22-16-10-8-6-4-2/h11-14,17-20,28-30H,3-10,15-16,21-23H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins by Cheng-Prusof...				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510004 (CHEMBL4541878) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(63.76,-29.3,;62.43,-30.08,;61.1,-29.31,;59.77,-30.09,;58.43,-29.33,;57.1,-30.11,;55.76,-29.34,;54.43,-30.12,;54.44,-31.66,;53.11,-32.44,;53.08,-30.53,;52.17,-31.78,;53.17,-33.99,;51.83,-34.74,;50.5,-35.52,;49.16,-34.75,;49.17,-33.2,;50.49,-32.43,;51.83,-33.19,;54.66,-34.4,;56,-35.17,;57.33,-34.39,;57.33,-32.84,;55.99,-32.08,;54.66,-32.85,;50.71,-31.3,;49.46,-32.21,;50.71,-29.76,;52.17,-29.29,;52.65,-27.82,)| Show InChI InChI=1S/C26H29NO3/c1-2-3-4-5-10-15-30-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(29)27-24(22)28/h6-9,11-14,21-23H,2-5,10,15-16H2,1H3,(H,27,28,29)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510006 (CHEMBL4448334) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(19.27,-16.24,;20.61,-17.01,;21.94,-16.24,;23.28,-17.01,;24.61,-16.24,;25.94,-17.01,;27.28,-16.24,;28.61,-17.01,;28.61,-18.55,;27.36,-19.45,;30.07,-19.02,;30.98,-17.78,;30.07,-16.53,;30.55,-15.07,;31.01,-19.68,;32.34,-18.91,;29.73,-20.44,;28.4,-19.68,;27.07,-20.45,;27.07,-21.99,;28.4,-22.76,;29.74,-21.99,;31.07,-21.23,;32.57,-21.64,;33.9,-22.41,;35.24,-21.64,;35.23,-20.09,;33.9,-19.33,;32.57,-20.1,)| Show InChI InChI=1S/C26H29NO2/c1-3-4-5-6-11-16-27-24(28)22-21-17-12-7-9-14-19(17)26(2,23(22)25(27)29)20-15-10-8-13-18(20)21/h7-10,12-15,21-23H,3-6,11,16H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.86E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510005 (CHEMBL4461463) Show SMILES CCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:26:27:9.10:20.15,7:9:20.15:27.22,11:10:20.15:27.22,16:15:9.10:27.22,THB:23:22:9.10:20.15,(39.21,-16.91,;40.55,-16.14,;41.88,-16.91,;43.21,-16.14,;44.55,-16.91,;45.88,-16.14,;47.22,-16.91,;47.21,-18.45,;45.97,-19.35,;48.68,-18.92,;49.58,-17.68,;48.68,-16.43,;49.16,-14.97,;49.62,-19.58,;50.95,-18.81,;48.34,-20.34,;47,-19.58,;45.67,-20.35,;45.67,-21.89,;47.01,-22.66,;48.34,-21.89,;49.67,-21.13,;51.17,-21.54,;52.51,-22.31,;53.84,-21.54,;53.84,-19.99,;52.5,-19.23,;51.17,-20,)| Show InChI InChI=1S/C25H27NO2/c1-3-4-5-10-15-26-23(27)21-20-16-11-6-8-13-18(16)25(2,22(21)24(26)28)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,3-5,10,15H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510009 (CHEMBL4586739) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(44.93,-29.24,;43.6,-30.02,;42.27,-29.26,;40.94,-30.04,;39.6,-29.27,;38.27,-30.05,;36.93,-29.29,;35.6,-30.07,;35.61,-31.61,;34.28,-32.38,;34.25,-30.48,;33.34,-31.72,;34.34,-33.93,;33.01,-34.69,;31.67,-35.46,;30.33,-34.69,;30.34,-33.15,;31.66,-32.38,;33,-33.14,;35.83,-34.34,;37.17,-35.11,;38.5,-34.34,;38.5,-32.79,;37.16,-32.03,;35.83,-32.8,;31.88,-31.25,;30.63,-32.15,;31.88,-29.71,;33.34,-29.23,;33.82,-27.77,)| Show InChI InChI=1S/C26H30N2O2/c1-2-3-4-5-10-15-27-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(30)28-24(22)29/h6-9,11-14,21-23,27H,2-5,10,15-16H2,1H3,(H,28,29,30)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.93E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.85E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510007 (CHEMBL4457335) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:24:25:10.11:18.13,8:10:18.13:25.20,26:11:18.13:25.20,14:13:10.11:25.20,THB:21:20:10.11:18.13,(31.74,-4.5,;33.07,-5.27,;34.4,-4.5,;35.74,-5.27,;37.07,-4.5,;38.4,-5.27,;39.74,-4.5,;41.07,-5.27,;41.07,-6.81,;39.82,-7.72,;42.54,-7.29,;43.44,-6.04,;43.48,-7.95,;42.19,-8.7,;40.86,-7.94,;39.53,-8.71,;39.53,-10.26,;40.86,-11.03,;42.2,-10.25,;43.53,-9.5,;45.03,-9.91,;46.36,-10.68,;47.7,-9.9,;47.69,-8.35,;46.36,-7.59,;45.03,-8.36,;42.54,-4.8,;43.01,-3.33,)| Show InChI InChI=1S/C25H27NO2/c1-2-3-4-5-10-15-26-24(27)22-20-16-11-6-7-12-17(16)21(23(22)25(26)28)19-14-9-8-13-18(19)20/h6-9,11-14,20-23H,2-5,10,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.94E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510002 (CHEMBL4585014) Show SMILES CCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:23:24:9.10:17.12,7:9:17.12:24.19,25:10:17.12:24.19,13:12:9.10:24.19,THB:20:19:9.10:17.12| Show InChI InChI=1S/C24H25NO2/c1-2-3-4-9-14-25-23(26)21-19-15-10-5-6-11-16(15)20(22(21)24(25)27)18-13-8-7-12-17(18)19/h5-8,10-13,19-22H,2-4,9,14H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510013 (CHEMBL4443830) Show SMILES CCCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:25:26:11.12:19.14,9:11:19.14:26.21,27:12:19.14:26.21,15:14:11.12:26.21,THB:22:21:11.12:19.14,(50.22,-4.88,;51.56,-4.11,;52.89,-4.88,;54.23,-4.11,;55.56,-4.88,;56.89,-4.11,;58.23,-4.88,;59.56,-4.11,;60.89,-4.88,;60.89,-6.42,;59.65,-7.33,;62.36,-6.9,;63.26,-5.65,;63.3,-7.56,;62.02,-8.31,;60.68,-7.55,;59.35,-8.32,;59.35,-9.87,;60.69,-10.64,;62.02,-9.87,;63.35,-9.11,;64.85,-9.52,;66.18,-10.29,;67.52,-9.51,;67.52,-7.96,;66.18,-7.2,;64.85,-7.97,;62.36,-4.41,;62.83,-2.94,)| Show InChI InChI=1S/C26H29NO2/c1-2-3-4-5-6-11-16-27-25(28)23-21-17-12-7-8-13-18(17)22(24(23)26(27)29)20-15-10-9-14-19(20)21/h7-10,12-15,21-24H,2-6,11,16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8.74E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510007 (CHEMBL4457335) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:24:25:10.11:18.13,8:10:18.13:25.20,26:11:18.13:25.20,14:13:10.11:25.20,THB:21:20:10.11:18.13,(31.74,-4.5,;33.07,-5.27,;34.4,-4.5,;35.74,-5.27,;37.07,-4.5,;38.4,-5.27,;39.74,-4.5,;41.07,-5.27,;41.07,-6.81,;39.82,-7.72,;42.54,-7.29,;43.44,-6.04,;43.48,-7.95,;42.19,-8.7,;40.86,-7.94,;39.53,-8.71,;39.53,-10.26,;40.86,-11.03,;42.2,-10.25,;43.53,-9.5,;45.03,-9.91,;46.36,-10.68,;47.7,-9.9,;47.69,-8.35,;46.36,-7.59,;45.03,-8.36,;42.54,-4.8,;43.01,-3.33,)| Show InChI InChI=1S/C25H27NO2/c1-2-3-4-5-10-15-26-24(27)22-20-16-11-6-7-12-17(16)21(23(22)25(26)28)19-14-9-8-13-18(19)20/h6-9,11-14,20-23H,2-5,10,15H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.35E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510003 (CHEMBL4586819) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Cl)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(2.19,-16.02,;3.52,-16.79,;4.86,-16.02,;6.19,-16.79,;7.52,-16.02,;8.86,-16.79,;10.19,-16.02,;11.52,-16.79,;11.52,-18.33,;10.28,-19.24,;12.99,-18.81,;13.89,-17.56,;12.99,-16.31,;13.46,-14.85,;13.93,-19.47,;15.26,-18.69,;12.65,-20.22,;11.31,-19.46,;9.98,-20.23,;9.98,-21.77,;11.32,-22.54,;12.65,-21.77,;13.98,-21.01,;15.48,-21.42,;16.81,-22.19,;18.15,-21.42,;18.15,-19.87,;16.81,-19.11,;15.48,-19.88,)| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.88E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510002 (CHEMBL4585014) Show SMILES CCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:23:24:9.10:17.12,7:9:17.12:24.19,25:10:17.12:24.19,13:12:9.10:24.19,THB:20:19:9.10:17.12| Show InChI InChI=1S/C24H25NO2/c1-2-3-4-9-14-25-23(26)21-19-15-10-5-6-11-16(15)20(22(21)24(25)27)18-13-8-7-12-17(18)19/h5-8,10-13,19-22H,2-4,9,14H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510010 (CHEMBL4569234) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(26.01,-29.39,;24.68,-30.16,;23.35,-29.4,;22.02,-30.18,;20.68,-29.42,;19.35,-30.19,;18.01,-29.43,;16.68,-30.21,;16.69,-31.75,;15.36,-32.53,;15.33,-30.62,;14.42,-31.87,;15.42,-34.07,;14.08,-34.83,;12.75,-35.6,;11.41,-34.83,;11.42,-33.29,;12.74,-32.52,;14.08,-33.28,;16.91,-34.48,;18.25,-35.25,;19.58,-34.48,;19.58,-32.93,;18.24,-32.17,;16.91,-32.94,;12.96,-31.39,;11.71,-32.29,;12.96,-29.85,;11.62,-29.08,;10.29,-29.85,;8.95,-29.08,;7.62,-29.85,;6.29,-29.08,;4.95,-29.85,;3.62,-29.08,;14.42,-29.37,;14.9,-27.91,)| Show InChI InChI=1S/C33H43NO3/c1-3-5-7-9-15-21-34-31(35)29-28-24-17-11-13-19-26(24)33(30(29)32(34)36,27-20-14-12-18-25(27)28)23-37-22-16-10-8-6-4-2/h11-14,17-20,28-30H,3-10,15-16,21-23H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510001 (CHEMBL4476184) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Br)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(69.39,-4.76,;70.72,-5.53,;72.05,-4.76,;73.39,-5.53,;74.72,-4.76,;76.05,-5.53,;77.39,-4.76,;78.72,-5.53,;78.72,-7.07,;77.48,-7.97,;80.19,-7.54,;81.09,-6.3,;80.19,-5.05,;80.66,-3.59,;81.13,-8.21,;82.46,-7.43,;79.85,-8.96,;78.51,-8.2,;77.18,-8.97,;77.18,-10.51,;78.51,-11.28,;79.85,-10.51,;81.18,-9.75,;82.68,-10.16,;84.01,-10.93,;85.35,-10.16,;85.34,-8.61,;84.01,-7.85,;82.68,-8.62,)| Show InChI InChI=1S/C25H26BrNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510008 (CHEMBL504005) Show SMILES O=C1NC(=O)C2C1C1c3ccccc3C2c2ccccc12 |TLB:9:8:20.15:6.5,19:20:8.13:6.5,THB:3:5:8.13:20.15,12:13:20.15:6.5,1:6:8.13:20.15,16:15:8.13:6.5,(-.27,-6.77,;-.12,-8.3,;1.2,-9.07,;.86,-10.58,;1.89,-11.73,;-.66,-10.72,;-1.28,-9.31,;-1.89,-11.58,;-3.23,-12.35,;-4.56,-11.59,;-5.88,-12.36,;-5.89,-13.91,;-4.55,-14.67,;-3.22,-13.91,;-1.9,-14.68,;-.55,-13.91,;.78,-14.67,;2.12,-13.91,;2.11,-12.35,;.78,-11.59,;-.54,-12.36,)| Show InChI InChI=1S/C18H13NO2/c20-17-15-13-9-5-1-2-6-10(9)14(16(15)18(21)19-17)12-8-4-3-7-11(12)13/h1-8,13-16H,(H,19,20,21)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50510011 (CHEMBL4458260) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18| Show InChI InChI=1S/C33H44N2O2/c1-3-5-7-9-15-21-34-23-33-26-19-13-11-17-24(26)28(25-18-12-14-20-27(25)33)29-30(33)32(37)35(31(29)36)22-16-10-8-6-4-2/h11-14,17-20,28-30,34H,3-10,15-16,21-23H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB2 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510013 (CHEMBL4443830) Show SMILES CCCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccccc32)C1=O |TLB:25:26:11.12:19.14,9:11:19.14:26.21,27:12:19.14:26.21,15:14:11.12:26.21,THB:22:21:11.12:19.14,(50.22,-4.88,;51.56,-4.11,;52.89,-4.88,;54.23,-4.11,;55.56,-4.88,;56.89,-4.11,;58.23,-4.88,;59.56,-4.11,;60.89,-4.88,;60.89,-6.42,;59.65,-7.33,;62.36,-6.9,;63.26,-5.65,;63.3,-7.56,;62.02,-8.31,;60.68,-7.55,;59.35,-8.32,;59.35,-9.87,;60.69,-10.64,;62.02,-9.87,;63.35,-9.11,;64.85,-9.52,;66.18,-10.29,;67.52,-9.51,;67.52,-7.96,;66.18,-7.2,;64.85,-7.97,;62.36,-4.41,;62.83,-2.94,)| Show InChI InChI=1S/C26H29NO2/c1-2-3-4-5-6-11-16-27-25(28)23-21-17-12-7-8-13-18(17)22(24(23)26(27)29)20-15-10-9-14-19(20)21/h7-10,12-15,21-24H,2-6,11,16H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510005 (CHEMBL4461463) Show SMILES CCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:26:27:9.10:20.15,7:9:20.15:27.22,11:10:20.15:27.22,16:15:9.10:27.22,THB:23:22:9.10:20.15,(39.21,-16.91,;40.55,-16.14,;41.88,-16.91,;43.21,-16.14,;44.55,-16.91,;45.88,-16.14,;47.22,-16.91,;47.21,-18.45,;45.97,-19.35,;48.68,-18.92,;49.58,-17.68,;48.68,-16.43,;49.16,-14.97,;49.62,-19.58,;50.95,-18.81,;48.34,-20.34,;47,-19.58,;45.67,-20.35,;45.67,-21.89,;47.01,-22.66,;48.34,-21.89,;49.67,-21.13,;51.17,-21.54,;52.51,-22.31,;53.84,-21.54,;53.84,-19.99,;52.5,-19.23,;51.17,-20,)| Show InChI InChI=1S/C25H27NO2/c1-3-4-5-10-15-26-23(27)21-20-16-11-6-8-13-18(16)25(2,22(21)24(26)28)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,3-5,10,15H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510004 (CHEMBL4541878) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(63.76,-29.3,;62.43,-30.08,;61.1,-29.31,;59.77,-30.09,;58.43,-29.33,;57.1,-30.11,;55.76,-29.34,;54.43,-30.12,;54.44,-31.66,;53.11,-32.44,;53.08,-30.53,;52.17,-31.78,;53.17,-33.99,;51.83,-34.74,;50.5,-35.52,;49.16,-34.75,;49.17,-33.2,;50.49,-32.43,;51.83,-33.19,;54.66,-34.4,;56,-35.17,;57.33,-34.39,;57.33,-32.84,;55.99,-32.08,;54.66,-32.85,;50.71,-31.3,;49.46,-32.21,;50.71,-29.76,;52.17,-29.29,;52.65,-27.82,)| Show InChI InChI=1S/C26H29NO3/c1-2-3-4-5-10-15-30-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(29)27-24(22)28/h6-9,11-14,21-23H,2-5,10,15-16H2,1H3,(H,27,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510012 (CHEMBL4578199) Show SMILES CCCCCCCN1C(=O)C2C(C3c4ccccc4C2c2ccc(Cl)cc32)C1=O |TLB:25:26:10.11:18.13,8:10:18.13:26.20,27:11:18.13:26.20,14:13:10.11:26.20,THB:21:20:10.11:18.13| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-8-13-27-24(28)22-20-16-9-6-7-10-17(16)21(23(22)25(27)29)19-14-15(26)11-12-18(19)20/h6-7,9-12,14,20-23H,2-5,8,13H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510009 (CHEMBL4586739) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)NC3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,28:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(44.93,-29.24,;43.6,-30.02,;42.27,-29.26,;40.94,-30.04,;39.6,-29.27,;38.27,-30.05,;36.93,-29.29,;35.6,-30.07,;35.61,-31.61,;34.28,-32.38,;34.25,-30.48,;33.34,-31.72,;34.34,-33.93,;33.01,-34.69,;31.67,-35.46,;30.33,-34.69,;30.34,-33.15,;31.66,-32.38,;33,-33.14,;35.83,-34.34,;37.17,-35.11,;38.5,-34.34,;38.5,-32.79,;37.16,-32.03,;35.83,-32.8,;31.88,-31.25,;30.63,-32.15,;31.88,-29.71,;33.34,-29.23,;33.82,-27.77,)| Show InChI InChI=1S/C26H30N2O2/c1-2-3-4-5-10-15-27-16-26-19-13-8-6-11-17(19)21(18-12-7-9-14-20(18)26)22-23(26)25(30)28-24(22)29/h6-9,11-14,21-23,27H,2-5,10,15-16H2,1H3,(H,28,29,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510003 (CHEMBL4586819) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(Cl)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(2.19,-16.02,;3.52,-16.79,;4.86,-16.02,;6.19,-16.79,;7.52,-16.02,;8.86,-16.79,;10.19,-16.02,;11.52,-16.79,;11.52,-18.33,;10.28,-19.24,;12.99,-18.81,;13.89,-17.56,;12.99,-16.31,;13.46,-14.85,;13.93,-19.47,;15.26,-18.69,;12.65,-20.22,;11.31,-19.46,;9.98,-20.23,;9.98,-21.77,;11.32,-22.54,;12.65,-21.77,;13.98,-21.01,;15.48,-21.42,;16.81,-22.19,;18.15,-21.42,;18.15,-19.87,;16.81,-19.11,;15.48,-19.88,)| Show InChI InChI=1S/C25H26ClNO2/c1-2-3-4-5-10-15-27-23(28)21-20-16-11-6-8-13-18(16)25(26,22(21)24(27)29)19-14-9-7-12-17(19)20/h6-9,11-14,20-22H,2-5,10,15H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510010 (CHEMBL4569234) Show SMILES CCCCCCCOCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18,(26.01,-29.39,;24.68,-30.16,;23.35,-29.4,;22.02,-30.18,;20.68,-29.42,;19.35,-30.19,;18.01,-29.43,;16.68,-30.21,;16.69,-31.75,;15.36,-32.53,;15.33,-30.62,;14.42,-31.87,;15.42,-34.07,;14.08,-34.83,;12.75,-35.6,;11.41,-34.83,;11.42,-33.29,;12.74,-32.52,;14.08,-33.28,;16.91,-34.48,;18.25,-35.25,;19.58,-34.48,;19.58,-32.93,;18.24,-32.17,;16.91,-32.94,;12.96,-31.39,;11.71,-32.29,;12.96,-29.85,;11.62,-29.08,;10.29,-29.85,;8.95,-29.08,;7.62,-29.85,;6.29,-29.08,;4.95,-29.85,;3.62,-29.08,;14.42,-29.37,;14.9,-27.91,)| Show InChI InChI=1S/C33H43NO3/c1-3-5-7-9-15-21-34-31(35)29-28-24-17-11-13-19-26(24)33(30(29)32(34)36,27-20-14-12-18-25(27)28)23-37-22-16-10-8-6-4-2/h11-14,17-20,28-30H,3-10,15-16,21-23H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510011 (CHEMBL4458260) Show SMILES CCCCCCCNCC12C3C(C(c4ccccc14)c1ccccc21)C(=O)N(CCCCCCC)C3=O |TLB:23:24:11.10:13.18,25:11:13.18:24.19,35:10:13.18:24.19,17:18:11.10:24.19,THB:20:19:11.10:13.18| Show InChI InChI=1S/C33H44N2O2/c1-3-5-7-9-15-21-34-23-33-26-19-13-11-17-24(26)28(25-18-12-14-20-27(25)33)29-30(33)32(37)35(31(29)36)22-16-10-8-6-4-2/h11-14,17-20,28-30,34H,3-10,15-16,21-23H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50510006 (CHEMBL4448334) Show SMILES CCCCCCCN1C(=O)C2C(C1=O)C1(C)c3ccccc3C2c2ccccc12 |TLB:27:28:10.11:21.16,8:10:21.16:28.23,12:11:21.16:28.23,17:16:10.11:28.23,THB:24:23:10.11:21.16,(19.27,-16.24,;20.61,-17.01,;21.94,-16.24,;23.28,-17.01,;24.61,-16.24,;25.94,-17.01,;27.28,-16.24,;28.61,-17.01,;28.61,-18.55,;27.36,-19.45,;30.07,-19.02,;30.98,-17.78,;30.07,-16.53,;30.55,-15.07,;31.01,-19.68,;32.34,-18.91,;29.73,-20.44,;28.4,-19.68,;27.07,-20.45,;27.07,-21.99,;28.4,-22.76,;29.74,-21.99,;31.07,-21.23,;32.57,-21.64,;33.9,-22.41,;35.24,-21.64,;35.23,-20.09,;33.9,-19.33,;32.57,-20.1,)| Show InChI InChI=1S/C26H29NO2/c1-3-4-5-6-11-16-27-24(28)22-21-17-12-7-9-14-19(17)26(2,23(22)25(27)29)20-15-10-8-13-18(20)21/h7-10,12-15,21-23H,3-6,11,16H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK293 cell membranes incubated for 90 mins				ACS Med Chem Lett 10: 596-600 (2019) Article DOI: 10.1021/acsmedchemlett.8b00594 BindingDB Entry DOI: 10.7270/Q20R9SQJ
					More data for this Ligand-Target Pair

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