Compile Data Set for Download or QSAR

Found 1165 hits with Last Name = 'rampa' and Initial = 'a'   

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
Acetylcholinesterase (Homo sapiens (Human))	BDBM50351015 (CHEMBL1819176) Show SMILES Clc1ccc2c(NCCCCCCCNc3c4Cc5ccccc5-c4nc4ccccc34)c3CCCCc3nc2c1 Show InChI InChI=1S/C36H37ClN4/c37-25-18-19-29-33(23-25)40-31-16-8-6-14-27(31)34(29)38-20-10-2-1-3-11-21-39-35-28-15-7-9-17-32(28)41-36-26-13-5-4-12-24(26)22-30(35)36/h4-5,7,9,12-13,15,17-19,23H,1-3,6,8,10-11,14,16,20-22H2,(H,38,40)(H,39,41)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Institut f£r Molekulare Physiologie Curated by ChEMBL					Assay Description Mixed-type inhibition of human AChE assessed as hydrolysis of acetylthiocholine by Lineweaver-Burk plot analysis				Eur J Med Chem 46: 4336-43 (2011) Article DOI: 10.1016/j.ejmech.2011.07.004 BindingDB Entry DOI: 10.7270/Q2NP24TK
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516288 (CHEMBL4530405) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(cc1)N(C)Cc1ccc(F)cc1 Show InChI InChI=1S/C30H24FNO3/c1-32(19-20-7-13-23(31)14-8-20)24-15-9-21(10-16-24)29(33)28-26-5-3-4-6-27(26)35-30(28)22-11-17-25(34-2)18-12-22/h3-18H,19H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516288 (CHEMBL4530405) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(cc1)N(C)Cc1ccc(F)cc1 Show InChI InChI=1S/C30H24FNO3/c1-32(19-20-7-13-23(31)14-8-20)24-15-9-21(10-16-24)29(33)28-26-5-3-4-6-27(26)35-30(28)22-11-17-25(34-2)18-12-22/h3-18H,19H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516303 (CHEMBL4473425) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2ccc(cc2)C#N)cc1 Show InChI InChI=1S/C30H22N2O3/c1-34-25-16-12-23(13-17-25)30-28(26-4-2-3-5-27(26)35-30)29(33)22-10-14-24(15-11-22)32-19-21-8-6-20(18-31)7-9-21/h2-17,32H,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516290 (CHEMBL4442990) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2ccc(F)cc2)cc1 Show InChI InChI=1S/C29H22FNO3/c1-33-24-16-10-21(11-17-24)29-27(25-4-2-3-5-26(25)34-29)28(32)20-8-14-23(15-9-20)31-18-19-6-12-22(30)13-7-19/h2-17,31H,18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	20	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM8960 ((+/-)-2-[(1-benzylpiperidin-4-yl)methyl]-5,6-dimet...) Show SMILES COc1cc2CC(CC3CCN(Cc4ccccc4)CC3)C(=O)c2cc1OC Show InChI InChI=1S/C24H29NO3/c1-27-22-14-19-13-20(24(26)21(19)15-23(22)28-2)12-17-8-10-25(11-9-17)16-18-6-4-3-5-7-18/h3-7,14-15,17,20H,8-13,16H2,1-2H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE PC cid PC sid PDB UniChem Patents Similars	DrugBank PDB Article PubMed	20.5	-45.6	23.1	n/a	n/a	n/a	n/a	8.0	37
University of Bologna					Assay Description The cholinesterase assays were performed using colorimetric method reported by Ellman. Estimates of the competitive inhibition constants (Ki) were ob...				J Med Chem 46: 2279-82 (2003) Article DOI: 10.1021/jm0340602 BindingDB Entry DOI: 10.7270/Q29Z9332
					More data for this Ligand-Target Pair				3D Structure (crystal)
Acetylcholinesterase (Homo sapiens (Human))	BDBM10949 (3-(4-{[Benzyl(methyl)amino]methyl}-phenyl)-6,7-dim...) Show SMILES COc1cc2cc(-c3ccc(CN(C)Cc4ccccc4)cc3)c(=O)oc2cc1OC Show InChI InChI=1S/C26H25NO4/c1-27(16-18-7-5-4-6-8-18)17-19-9-11-20(12-10-19)22-13-21-14-24(29-2)25(30-3)15-23(21)31-26(22)28/h4-15H,16-17H2,1-3H3	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	21.7	-45.5	44.5	n/a	n/a	n/a	n/a	8.0	37
University of Bologna					Assay Description The cholinesterase assays were performed using colorimetric method reported by Ellman. Estimates of the competitive inhibition constants (Ki) were ob...				J Med Chem 46: 2279-82 (2003) Article DOI: 10.1021/jm0340602 BindingDB Entry DOI: 10.7270/Q29Z9332
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM50308280 (2-{4-[(Benzylmethylamino)methyl]benzylidene}-6-(5-...) Show SMILES CN(Cc1ccccc1)Cc1ccc(\C=C2/CCc3cc(OCCCCCN4CCCCC4)ccc3C2=O)cc1 Show InChI InChI=1S/C36H44N2O2/c1-37(27-30-11-5-2-6-12-30)28-31-15-13-29(14-16-31)25-33-18-17-32-26-34(19-20-35(32)36(33)39)40-24-10-4-9-23-38-21-7-3-8-22-38/h2,5-6,11-16,19-20,25-26H,3-4,7-10,17-18,21-24,27-28H2,1H3/b33-25+	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	61.1	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna Curated by ChEMBL					Assay Description Inhibition of human recombinant AChE-mediated hydrolysis of acetylcholine by Lineweaver-Burk plot analysis				Bioorg Med Chem 18: 1749-60 (2010) Article DOI: 10.1016/j.bmc.2010.01.071 BindingDB Entry DOI: 10.7270/Q2P26Z7H
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516291 (CHEMBL4454301) Show SMILES CCCCCNc1ccc(cc1)C(=O)c1c(oc2ccccc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C27H27NO3/c1-3-4-7-18-28-21-14-10-19(11-15-21)26(29)25-23-8-5-6-9-24(23)31-27(25)20-12-16-22(30-2)17-13-20/h5-6,8-17,28H,3-4,7,18H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516291 (CHEMBL4454301) Show SMILES CCCCCNc1ccc(cc1)C(=O)c1c(oc2ccccc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C27H27NO3/c1-3-4-7-18-28-21-14-10-19(11-15-21)26(29)25-23-8-5-6-9-24(23)31-27(25)20-12-16-22(30-2)17-13-20/h5-6,8-17,28H,3-4,7,18H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516298 (CHEMBL4520615) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCC2CC2)cc1 Show InChI InChI=1S/C26H23NO3/c1-29-21-14-10-19(11-15-21)26-24(22-4-2-3-5-23(22)30-26)25(28)18-8-12-20(13-9-18)27-16-17-6-7-17/h2-5,8-15,17,27H,6-7,16H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	110	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516289 (CHEMBL4527727) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C33H31NO4/c1-34(23-24-9-4-3-5-10-24)21-8-22-37-28-19-13-25(14-20-28)32(35)31-29-11-6-7-12-30(29)38-33(31)26-15-17-27(36-2)18-16-26/h3-7,9-20H,8,21-23H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	120	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM8961 (1,2,3,4-tetrahydro-9-acridinamine | 1,2,3,4-tetrah...) Show SMILES Nc1c2CCCCc2nc2ccccc12 Show InChI InChI=1S/C13H14N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1,3,5,7H,2,4,6,8H2,(H2,14,15)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	151	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna					Assay Description The cholinesterase assays were performed using colorimetric method reported by Ellman. The absorbance changes at 412 nm were recorded for 5 min with ...				Bioorg Med Chem 8: 497-506 (2000) Article DOI: 10.1016/s0968-0896(99)00306-5 BindingDB Entry DOI: 10.7270/Q2BG2M6F
					More data for this Ligand-Target Pair				3D Structure (crystal)
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516300 (CHEMBL4464357) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2ccccc2)cc1 Show InChI InChI=1S/C29H23NO3/c1-32-24-17-13-22(14-18-24)29-27(25-9-5-6-10-26(25)33-29)28(31)21-11-15-23(16-12-21)30-19-20-7-3-2-4-8-20/h2-18,30H,19H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	170	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Acetylcholinesterase (Homo sapiens (Human))	BDBM9074 (10H-indeno[1,2-b]quinolin-11-amine | 11H-indeno-[1...) Show SMILES Nc1c2Cc3ccccc3-c2nc2ccccc12 Show InChI InChI=1S/C16H12N2/c17-15-12-7-3-4-8-14(12)18-16-11-6-2-1-5-10(11)9-13(15)16/h1-8H,9H2,(H2,17,18)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	210	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
University of Bologna					Assay Description The cholinesterase assays were performed using colorimetric method reported by Ellman. The absorbance changes at 412 nm were recorded for 5 min with ...				Bioorg Med Chem 8: 497-506 (2000) Article DOI: 10.1016/s0968-0896(99)00306-5 BindingDB Entry DOI: 10.7270/Q2BG2M6F
					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 UniProtKB/TrEMBL 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))	BDBM50516295 (CHEMBL4473103) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2cc(F)cc(F)c2)cc1 Show InChI InChI=1S/C29H21F2NO3/c1-34-24-12-8-20(9-13-24)29-27(25-4-2-3-5-26(25)35-29)28(33)19-6-10-23(11-7-19)32-17-18-14-21(30)16-22(31)15-18/h2-16,32H,17H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50261233 ((2-{4-[7-(benzylmethylamino)heptyloxy]phenyl}benzo...) Show SMILES CN(CCCCCCCOc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C36H37NO3/c1-37(27-28-15-7-5-8-16-28)25-13-3-2-4-14-26-39-31-23-21-30(22-24-31)36-34(32-19-11-12-20-33(32)40-36)35(38)29-17-9-6-10-18-29/h5-12,15-24H,2-4,13-14,25-27H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	320	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]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516299 (CHEMBL4471684) Show SMILES CCCCCCCNc1ccc(cc1)C(=O)c1c(oc2ccccc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C29H31NO3/c1-3-4-5-6-9-20-30-23-16-12-21(13-17-23)28(31)27-25-10-7-8-11-26(25)33-29(27)22-14-18-24(32-2)19-15-22/h7-8,10-19,30H,3-6,9,20H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	410	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516292 (CHEMBL4587421) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C32H29NO4/c1-33(22-23-8-4-3-5-9-23)20-21-36-27-18-12-24(13-19-27)31(34)30-28-10-6-7-11-29(28)37-32(30)25-14-16-26(35-2)17-15-25/h3-19H,20-22H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	430	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516287 (CHEMBL4543379) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(cc1)N(Cc1ccc(F)cc1)Cc1ccc(F)cc1 Show InChI InChI=1S/C36H27F2NO3/c1-41-31-20-12-27(13-21-31)36-34(32-4-2-3-5-33(32)42-36)35(40)26-10-18-30(19-11-26)39(22-24-6-14-28(37)15-7-24)23-25-8-16-29(38)17-9-25/h2-21H,22-23H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	430	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516298 (CHEMBL4520615) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCC2CC2)cc1 Show InChI InChI=1S/C26H23NO3/c1-29-21-14-10-19(11-15-21)26-24(22-4-2-3-5-23(22)30-26)25(28)18-8-12-20(13-9-18)27-16-17-6-7-17/h2-5,8-15,17,27H,6-7,16H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	470	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516289 (CHEMBL4527727) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C33H31NO4/c1-34(23-24-9-4-3-5-10-24)21-8-22-37-28-19-13-25(14-20-28)32(35)31-29-11-6-7-12-30(29)38-33(31)26-15-17-27(36-2)18-16-26/h3-7,9-20H,8,21-23H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	500	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50394567 (CHEMBL2160225) Show SMILES CN(CCCCCCCOc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCN2CCOCC2)cc1)Cc1ccccc1 Show InChI InChI=1S/C42H48N2O5/c1-43(32-33-12-6-5-7-13-33)24-10-3-2-4-11-28-47-36-22-18-35(19-23-36)42-40(38-14-8-9-15-39(38)49-42)41(45)34-16-20-37(21-17-34)48-31-27-44-25-29-46-30-26-44/h5-9,12-23H,2-4,10-11,24-32H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	550	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]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50394567 (CHEMBL2160225) Show SMILES CN(CCCCCCCOc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCN2CCOCC2)cc1)Cc1ccccc1 Show InChI InChI=1S/C42H48N2O5/c1-43(32-33-12-6-5-7-13-33)24-10-3-2-4-11-28-47-36-22-18-35(19-23-36)42-40(38-14-8-9-15-39(38)49-42)41(45)34-16-20-37(21-17-34)48-31-27-44-25-29-46-30-26-44/h5-9,12-23H,2-4,10-11,24-32H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	580	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]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50394568 (CHEMBL2160223) Show SMILES CCN(CC)CCOc1cccc(c1)C(=O)c1c(oc2ccccc12)-c1ccc(OCCCCCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C42H50N2O4/c1-4-44(5-2)28-30-47-37-20-16-19-35(31-37)41(45)40-38-21-12-13-22-39(38)48-42(40)34-23-25-36(26-24-34)46-29-15-8-6-7-14-27-43(3)32-33-17-10-9-11-18-33/h9-13,16-26,31H,4-8,14-15,27-30,32H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	690	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]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516292 (CHEMBL4587421) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C32H29NO4/c1-33(22-23-8-4-3-5-9-23)20-21-36-27-18-12-24(13-19-27)31(34)30-28-10-6-7-11-29(28)37-32(30)25-14-16-26(35-2)17-15-25/h3-19H,20-22H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	690	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516290 (CHEMBL4442990) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2ccc(F)cc2)cc1 Show InChI InChI=1S/C29H22FNO3/c1-33-24-16-10-21(11-17-24)29-27(25-4-2-3-5-26(25)34-29)28(32)20-8-14-23(15-9-20)31-18-19-6-12-22(30)13-7-19/h2-17,31H,18H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	780	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516293 (CHEMBL4552932) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C34H33NO4/c1-35(24-25-10-4-3-5-11-25)22-8-9-23-38-29-20-14-26(15-21-29)33(36)32-30-12-6-7-13-31(30)39-34(32)27-16-18-28(37-2)19-17-27/h3-7,10-21H,8-9,22-24H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	860	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516301 (CHEMBL4532907) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(cc1)N(Cc1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C36H29NO3/c1-39-31-22-18-29(19-23-31)36-34(32-14-8-9-15-33(32)40-36)35(38)28-16-20-30(21-17-28)37(24-26-10-4-2-5-11-26)25-27-12-6-3-7-13-27/h2-23H,24-25H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	920	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					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 UniProtKB/TrEMBL 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 UniProtKB/TrEMBL 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 UniProtKB/TrEMBL 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))	BDBM50516297 (CHEMBL4537149) Show SMILES COc1ccc(CNc2ccc(cc2)C(=O)c2c(oc3ccccc23)-c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C30H25NO4/c1-33-24-15-7-20(8-16-24)19-31-23-13-9-21(10-14-23)29(32)28-26-5-3-4-6-27(26)35-30(28)22-11-17-25(34-2)18-12-22/h3-18,31H,19H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.02E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50394569 (CHEMBL2160222) Show SMILES CCN(CC)Cc1ccc(cc1)C(=O)c1c(oc2ccccc12)-c1ccc(OCCCCCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C41H48N2O3/c1-4-43(5-2)31-33-20-22-34(23-21-33)40(44)39-37-18-12-13-19-38(37)46-41(39)35-24-26-36(27-25-35)45-29-15-8-6-7-14-28-42(3)30-32-16-10-9-11-17-32/h9-13,16-27H,4-8,14-15,28-31H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.12E+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]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50394570 (CHEMBL2160224) Show SMILES CCN(CC)CCOc1ccc(cc1)C(=O)c1c(oc2ccccc12)-c1ccc(OCCCCCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C42H50N2O4/c1-4-44(5-2)29-31-47-37-24-20-34(21-25-37)41(45)40-38-18-12-13-19-39(38)48-42(40)35-22-26-36(27-23-35)46-30-15-8-6-7-14-28-43(3)32-33-16-10-9-11-17-33/h9-13,16-27H,4-8,14-15,28-32H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.18E+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]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50516302 (CHEMBL4566417) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2ccccn2)cc1 Show InChI InChI=1S/C28H22N2O3/c1-32-23-15-11-20(12-16-23)28-26(24-7-2-3-8-25(24)33-28)27(31)19-9-13-21(14-10-19)30-18-22-6-4-5-17-29-22/h2-17,30H,18H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.34E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516299 (CHEMBL4471684) Show SMILES CCCCCCCNc1ccc(cc1)C(=O)c1c(oc2ccccc12)-c1ccc(OC)cc1 Show InChI InChI=1S/C29H31NO3/c1-3-4-5-6-9-20-30-23-16-12-21(13-17-23)28(31)27-25-10-7-8-11-26(25)33-29(27)22-14-18-24(32-2)19-15-22/h7-8,10-19,30H,3-6,9,20H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.66E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					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 UniProtKB/TrEMBL 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 1 (Homo sapiens (Human))	BDBM50516294 (CHEMBL4539701) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(OCCCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C35H35NO4/c1-36(25-26-11-5-3-6-12-26)23-9-4-10-24-39-30-21-15-27(16-22-30)34(37)33-31-13-7-8-14-32(31)40-35(33)28-17-19-29(38-2)20-18-28/h3,5-8,11-22H,4,9-10,23-25H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.76E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50394572 (CHEMBL2160219) Show SMILES CN(CCCCCCCOc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(cc1)-c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C42H41NO3/c1-43(31-32-15-7-5-8-16-32)29-13-3-2-4-14-30-45-37-27-25-36(26-28-37)42-40(38-19-11-12-20-39(38)46-42)41(44)35-23-21-34(22-24-35)33-17-9-6-10-18-33/h5-12,15-28H,2-4,13-14,29-31H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.79E+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]CP-55940 from human recombinant CB2 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50200170 (5-(4-chloro-3-methyl-phenyl)-1-(4-methyl-benzyl)-1...) Show SMILES Cc1ccc(Cn2nc(cc2-c2ccc(Cl)c(C)c2)C(=O)N[C@H]2[C@@]3(C)CC[C@H](C3)C2(C)C)cc1 |r| Show InChI InChI=1S/C29H34ClN3O/c1-18-6-8-20(9-7-18)17-33-25(21-10-11-23(30)19(2)14-21)15-24(32-33)26(34)31-27-28(3,4)22-12-13-29(27,5)16-22/h6-11,14-15,22,27H,12-13,16-17H2,1-5H3,(H,31,34)/t22-,27-,29+/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	1.82E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB2 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					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 UniProtKB/TrEMBL 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 UniProtKB/TrEMBL 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 UniProtKB/TrEMBL 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 UniProtKB/TrEMBL 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))	BDBM50394568 (CHEMBL2160223) Show SMILES CCN(CC)CCOc1cccc(c1)C(=O)c1c(oc2ccccc12)-c1ccc(OCCCCCCCN(C)Cc2ccccc2)cc1 Show InChI InChI=1S/C42H50N2O4/c1-4-44(5-2)28-30-47-37-20-16-19-35(31-37)41(45)40-38-21-12-13-22-39(38)48-42(40)34-23-25-36(26-24-34)46-29-15-8-6-7-14-27-43(3)32-33-17-10-9-11-18-33/h9-13,16-26,31H,4-8,14-15,27-30,32H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.57E+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]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50516303 (CHEMBL4473425) Show SMILES COc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(NCc2ccc(cc2)C#N)cc1 Show InChI InChI=1S/C30H22N2O3/c1-34-25-16-12-23(13-17-25)30-28(26-4-2-3-5-27(26)35-30)29(33)22-10-14-24(15-11-22)32-19-21-8-6-20(18-31)7-9-21/h2-17,32H,19H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Alma Mater Studiorum-University of Bologna Curated by ChEMBL					Assay Description Displacement of 3[H]-CP55940 from human recombinant CB1 receptor expressed in HEK293 cell membranes measured after 90 mins by Cheng-Prusoff equation ...				Eur J Med Chem 178: 243-258 (2019) Article DOI: 10.1016/j.ejmech.2019.05.080 BindingDB Entry DOI: 10.7270/Q2VX0KVX
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50261202 (CHEMBL497755 | [7-(4-Benzofuran-2-yl-phenoxy)hepht...) Show SMILES CN(CCCCCCCOc1ccc(cc1)-c1cc2ccccc2o1)Cc1ccccc1 Show InChI InChI=1S/C29H33NO2/c1-30(23-24-12-6-5-7-13-24)20-10-3-2-4-11-21-31-27-18-16-25(17-19-27)29-22-26-14-8-9-15-28(26)32-29/h5-9,12-19,22H,2-4,10-11,20-21,23H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	2.80E+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]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50394572 (CHEMBL2160219) Show SMILES CN(CCCCCCCOc1ccc(cc1)-c1oc2ccccc2c1C(=O)c1ccc(cc1)-c1ccccc1)Cc1ccccc1 Show InChI InChI=1S/C42H41NO3/c1-43(31-32-15-7-5-8-16-32)29-13-3-2-4-14-30-45-37-27-25-36(26-28-37)42-40(38-19-11-12-20-39(38)46-42)41(44)35-23-21-34(22-24-35)33-17-9-6-10-18-33/h5-12,15-28H,2-4,13-14,29-31H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	3.12E+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]CP-55940 from human recombinant CB1 receptor expressed in HEK293 cells after 90 mins				Eur J Med Chem 58: 519-32 (2012) Article DOI: 10.1016/j.ejmech.2012.10.045 BindingDB Entry DOI: 10.7270/Q2XW4KW5
					More data for this Ligand-Target Pair

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