BDBM50398227 CHEMBL2177259

SMILES: CCCCCc1cc(OC)c2cc(Cc3ccccc3Cl)c(=O)oc2c1

InChI Key: InChIKey=PSWHWCGBEPXOFQ-UHFFFAOYSA-N

Data: 2 KI  2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50398227   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50398227 (CHEMBL2177259) Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C22H23ClO3/c1-3-4-5-8-15-11-20(25-2)18-14-17(22(24)26-21(18)12-15)13-16-9-6-7-10-19(16)23/h6-7,9-12,14H,3-5,8,13H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	33	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))	BDBM50398227 (CHEMBL2177259) Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C22H23ClO3/c1-3-4-5-8-15-11-20(25-2)18-14-17(22(24)26-21(18)12-15)13-16-9-6-7-10-19(16)23/h6-7,9-12,14H,3-5,8,13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	185	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
N-arachidonyl glycine receptor (Homo sapiens (Human))	BDBM50398227 (CHEMBL2177259) Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C22H23ClO3/c1-3-4-5-8-15-11-20(25-2)18-14-17(22(24)26-21(18)12-15)13-16-9-6-7-10-19(16)23/h6-7,9-12,14H,3-5,8,13H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL 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))	BDBM50398227 (CHEMBL2177259) Show SMILES CCCCCc1cc(OC)c2cc(Cc3ccccc3Cl)c(=O)oc2c1 Show InChI InChI=1S/C22H23ClO3/c1-3-4-5-8-15-11-20(25-2)18-14-17(22(24)26-21(18)12-15)13-16-9-6-7-10-19(16)23/h6-7,9-12,14H,3-5,8,13H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.00E+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