BDBM50287932 CHEMBL56249::Phosphoric acid (6aR,10aR)-3-(1,1-dimethyl-heptyl)-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-yl ester diethyl ester
SMILES: CCCCCCC(C)(C)c1cc(OP(=O)(OCC)OCC)c2[C@@H]3CC(C)=CC[C@H]3C(C)(C)Oc2c1
InChI Key: InChIKey=XRKWHUJWNHCGIL-DNQXCXABSA-N
Data: 3 KI
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)) | BDBM50287932 (CHEMBL56249 | Phosphoric acid (6aR,10aR)-3-(1,1-di...) | PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article | 442 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Binding affinity against human Cannabinoid receptor 2 by using radioligand ([3H]-CP-55,940) assay. | Bioorg Med Chem Lett 6: 189-194 (1996) Article DOI: 10.1016/0960-894X(95)00573-C BindingDB Entry DOI: 10.7270/Q2KS6RHX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 1 (Homo sapiens (Human)) | BDBM50287932 (CHEMBL56249 | Phosphoric acid (6aR,10aR)-3-(1,1-di...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was evaluated for binding affinity against human cannabinoid receptor by using radioligand ([3H]-CP-55,940) assay; second determination | Bioorg Med Chem Lett 6: 189-194 (1996) Article DOI: 10.1016/0960-894X(95)00573-C BindingDB Entry DOI: 10.7270/Q2KS6RHX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Cannabinoid receptor 1 (Homo sapiens (Human)) | BDBM50287932 (CHEMBL56249 | Phosphoric acid (6aR,10aR)-3-(1,1-di...) | PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | Article | >2.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Compound was evaluated for binding affinity against human cannabinoid receptor by using radioligand ([3H]-CP-55,940) assay; first determination | Bioorg Med Chem Lett 6: 189-194 (1996) Article DOI: 10.1016/0960-894X(95)00573-C BindingDB Entry DOI: 10.7270/Q2KS6RHX | |||||||||||
More data for this Ligand-Target Pair |