BDBM50325036 CHEMBL1223234::[6,6-Dimethyl-3-(2-methyl-allyl)-4-oxo-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-2-ylsulfanyl]-acetic acid methyl ester
SMILES: COC(=O)CSc1nc2sc3COC(C)(C)Cc3c2c(=O)n1CC(C)=C
InChI Key: InChIKey=VWHKMIMNGUMZLO-UHFFFAOYSA-N
Data: 1 IC50
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)) | BDBM50325036 (CHEMBL1223234 | [6,6-Dimethyl-3-(2-methyl-allyl)-4...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | Purchase CHEMBL PC cid PC sid UniChem | Article PubMed | n/a | n/a | 290 | n/a | n/a | n/a | n/a | n/a | n/a |
Korea Research Institute of Chemical Technology Curated by ChEMBL | Assay Description Inhibition of human CB1 receptor expressed in CHOK1 cells by luciferase reporter gene assay | Bioorg Med Chem Lett 20: 5130-2 (2010) Article DOI: 10.1016/j.bmcl.2010.07.018 BindingDB Entry DOI: 10.7270/Q23778X1 | |||||||||||
More data for this Ligand-Target Pair |