Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50389929'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50389929 (CHEMBL2071064) Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1 Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	470	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation in presence o...				J Med Chem 58: 5979-88 (2015) Article DOI: 10.1021/acs.jmedchem.5b00579 BindingDB Entry DOI: 10.7270/Q2PG1TG7
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50389929 (CHEMBL2071064) Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1 Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	1.01E+3	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...				J Med Chem 58: 5979-88 (2015) Article DOI: 10.1021/acs.jmedchem.5b00579 BindingDB Entry DOI: 10.7270/Q2PG1TG7
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50389929 (CHEMBL2071064) Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1 Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	550	n/a	n/a	n/a	n/a
Sapienza Universit£ di Roma Curated by ChEMBL					Assay Description Allosteric modulation of human recombinant CB1 receptor expressed in HEK293 cells assessed as stimulation of [3H]CP55940 binding				J Med Chem 55: 5627-31 (2012) Article DOI: 10.1021/jm201485c BindingDB Entry DOI: 10.7270/Q27W6D8K
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50389929 (CHEMBL2071064) Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1 Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	790	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 15 mins...				J Med Chem 58: 5979-88 (2015) Article DOI: 10.1021/acs.jmedchem.5b00579 BindingDB Entry DOI: 10.7270/Q2PG1TG7
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50389929 (CHEMBL2071064) Show SMILES CCc1c([nH]c2ccc(Cl)cc12)C(=O)NCCc1ccc(C)cc1 Show InChI InChI=1S/C20H21ClN2O/c1-3-16-17-12-15(21)8-9-18(17)23-19(16)20(24)22-11-10-14-6-4-13(2)5-7-14/h4-9,12,23H,3,10-11H2,1-2H3,(H,22,24)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	600	n/a	n/a	n/a	n/a
University of Auckland Curated by ChEMBL					Assay Description Activity at hemagglutinin-tagged human CB1 receptor expressed in HEK293 cells assessed as effect on forskolin-induced cAMP accumulation after 10 mins...				J Med Chem 58: 5979-88 (2015) Article DOI: 10.1021/acs.jmedchem.5b00579 BindingDB Entry DOI: 10.7270/Q2PG1TG7
					More data for this Ligand-Target Pair