Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 308.3 BDBM50398212

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 5 hits in this display   

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))	BDBM50398212 (CHEMBL2181549) Show SMILES CC(C)c1ccc(C)c2oc(=O)c(Cc3ccccc3O)cc12 Show InChI InChI=1S/C20H20O3/c1-12(2)16-9-8-13(3)19-17(16)11-15(20(22)23-19)10-14-6-4-5-7-18(14)21/h4-9,11-12,21H,10H2,1-3H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Displacement of [3H]CP55,940 from human CB1 receptor expressed in CHO cells after 2 hrs by liquid scintillation counter				J Med Chem 55: 7967-77 (2012) Article DOI: 10.1021/jm3008213 BindingDB Entry DOI: 10.7270/Q2JM2BRJ
					More data for this Ligand-Target Pair
Cannabinoid receptor 2 (Homo sapiens (Human))	BDBM50398212 (CHEMBL2181549) Show SMILES CC(C)c1ccc(C)c2oc(=O)c(Cc3ccccc3O)cc12 Show InChI InChI=1S/C20H20O3/c1-12(2)16-9-8-13(3)19-17(16)11-15(20(22)23-19)10-14-6-4-5-7-18(14)21/h4-9,11-12,21H,10H2,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Displacement of [3H]CP55,940 from human CB2 receptor expressed in CHO cells after 2 hrs by liquid scintillation counter				J Med Chem 55: 7967-77 (2012) Article DOI: 10.1021/jm3008213 BindingDB Entry DOI: 10.7270/Q2JM2BRJ
					More data for this Ligand-Target Pair
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM50398212 (CHEMBL2181549) Show SMILES CC(C)c1ccc(C)c2oc(=O)c(Cc3ccccc3O)cc12 Show InChI InChI=1S/C20H20O3/c1-12(2)16-9-8-13(3)19-17(16)11-15(20(22)23-19)10-14-6-4-5-7-18(14)21/h4-9,11-12,21H,10H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.77E+3	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Antagonist activity at human GPR55 transfected in CHO cells assessed as inhibition of LPI-induced beta-arrestin recruitment incubated 60 mins prior t...				J Med Chem 56: 4798-810 (2013) Article DOI: 10.1021/jm4005175 BindingDB Entry DOI: 10.7270/Q2GM88QX
					More data for this Ligand-Target Pair
N-arachidonyl glycine receptor (Homo sapiens (Human))	BDBM50398212 (CHEMBL2181549) Show SMILES CC(C)c1ccc(C)c2oc(=O)c(Cc3ccccc3O)cc12 Show InChI InChI=1S/C20H20O3/c1-12(2)16-9-8-13(3)19-17(16)11-15(20(22)23-19)10-14-6-4-5-7-18(14)21/h4-9,11-12,21H,10H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Antagonist activity at human GPR18 transfected in CHO cells assessed as delta9-THC-induced beta-arrestin recruitment incubated 60 mins prior to delta...				J Med Chem 56: 4798-810 (2013) Article DOI: 10.1021/jm4005175 BindingDB Entry DOI: 10.7270/Q2GM88QX
					More data for this Ligand-Target Pair
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM50398212 (CHEMBL2181549) Show SMILES CC(C)c1ccc(C)c2oc(=O)c(Cc3ccccc3O)cc12 Show InChI InChI=1S/C20H20O3/c1-12(2)16-9-8-13(3)19-17(16)11-15(20(22)23-19)10-14-6-4-5-7-18(14)21/h4-9,11-12,21H,10H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.84E+8	n/a	n/a	n/a	n/a	n/a
University of Bonn Curated by ChEMBL					Assay Description Antagonist activity at human GPR55 transfected in CHO cells assessed as inhibition of LPI-induced beta-arrestin recruitment incubated 60 mins prior t...				J Med Chem 56: 4798-810 (2013) Article DOI: 10.1021/jm4005175 BindingDB Entry DOI: 10.7270/Q2GM88QX
					More data for this Ligand-Target Pair