Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 356.8 BDBM50398226

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

Found 4 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 2 (Homo sapiens (Human))	BDBM50398226 (CHEMBL2177260) Show SMILES CCCCCc1cc(O)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C21H21ClO3/c1-2-3-4-7-14-10-19(23)17-13-16(21(24)25-20(17)11-14)12-15-8-5-6-9-18(15)22/h5-6,8-11,13,23H,2-4,7,12H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.94E+3	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
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50398226 (CHEMBL2177260) Show SMILES CCCCCc1cc(O)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C21H21ClO3/c1-2-3-4-7-14-10-19(23)17-13-16(21(24)25-20(17)11-14)12-15-8-5-6-9-18(15)22/h5-6,8-11,13,23H,2-4,7,12H2,1H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.91E+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
G-protein coupled receptor 55 (Homo sapiens (Human))	BDBM50398226 (CHEMBL2177260) Show SMILES CCCCCc1cc(O)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C21H21ClO3/c1-2-3-4-7-14-10-19(23)17-13-16(21(24)25-20(17)11-14)12-15-8-5-6-9-18(15)22/h5-6,8-11,13,23H,2-4,7,12H2,1H3	Reactome pathway KEGG UniProtKB/SwissProt 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 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))	BDBM50398226 (CHEMBL2177260) Show SMILES CCCCCc1cc(O)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C21H21ClO3/c1-2-3-4-7-14-10-19(23)17-13-16(21(24)25-20(17)11-14)12-15-8-5-6-9-18(15)22/h5-6,8-11,13,23H,2-4,7,12H2,1H3	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