BDBM50061196 8,8,11-Trimethyl-5-pentyl-3,4,8a,9,10,12a-hexahydro-2H,8H-1,7-dioxa-benzo[c]phenanthrene::CHEMBL114189

SMILES: CCCCCc1cc2OC(C)(C)C3CCC(C)=CC3c2c2OCCCc12

InChI Key: InChIKey=ZSWRBXLXOXOSOJ-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50061196   

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 2 (Homo sapiens (Human))	BDBM50061196 (8,8,11-Trimethyl-5-pentyl-3,4,8a,9,10,12a-hexahydr...) Show SMILES CCCCCc1cc2OC(C)(C)C3CCC(C)=CC3c2c2OCCCc12 |c:16| Show InChI InChI=1S/C24H34O2/c1-5-6-7-9-17-15-21-22(23-18(17)10-8-13-25-23)19-14-16(2)11-12-20(19)24(3,4)26-21/h14-15,19-20H,5-13H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	36	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kennesaw State University Curated by ChEMBL					Assay Description Binding affinity of the compound for Cannabinoid receptor 2				J Med Chem 40: 3312-8 (1997) Article DOI: 10.1021/jm970136g BindingDB Entry DOI: 10.7270/Q2V123WC
					More data for this Ligand-Target Pair
Cannabinoid receptor 1 (Homo sapiens (Human))	BDBM50061196 (8,8,11-Trimethyl-5-pentyl-3,4,8a,9,10,12a-hexahydr...) Show SMILES CCCCCc1cc2OC(C)(C)C3CCC(C)=CC3c2c2OCCCc12 |c:16| Show InChI InChI=1S/C24H34O2/c1-5-6-7-9-17-15-21-22(23-18(17)10-8-13-25-23)19-14-16(2)11-12-20(19)24(3,4)26-21/h14-15,19-20H,5-13H2,1-4H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	41	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Kennesaw State University Curated by ChEMBL					Assay Description Binding affinity of the compound for cannabinoid receptor 1.				J Med Chem 40: 3312-8 (1997) Article DOI: 10.1021/jm970136g BindingDB Entry DOI: 10.7270/Q2V123WC
					More data for this Ligand-Target Pair