BDBM50306530 (6aR,10aR)-6,6,9-trimethyl-3-(2-methyloctan-2-yl)-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-amine::CHEMBL604746
SMILES: CCCCCCC(C)(C)c1cc(N)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1
InChI Key: InChIKey=XCSQASXDTQFUHI-WOJBJXKFSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50306530 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)) | BDBM50306530
((6aR,10aR)-6,6,9-trimethyl-3-(2-methyloctan-2-yl)-...)Show SMILES CCCCCCC(C)(C)c1cc(N)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1 |r,t:15| Show InChI InChI=1S/C25H39NO/c1-7-8-9-10-13-24(3,4)18-15-21(26)23-19-14-17(2)11-12-20(19)25(5,6)27-22(23)16-18/h14-16,19-20H,7-13,26H2,1-6H3/t19-,20-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 2.90 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
AMRI
Curated by ChEMBL
| Assay Description Displacement of [3H]CP-55940 from CB2 receptor |
Bioorg Med Chem Lett 20: 1424-6 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.092 BindingDB Entry DOI: 10.7270/Q2PC32GV |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50306530
((6aR,10aR)-6,6,9-trimethyl-3-(2-methyloctan-2-yl)-...)Show SMILES CCCCCCC(C)(C)c1cc(N)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1 |r,t:15| Show InChI InChI=1S/C25H39NO/c1-7-8-9-10-13-24(3,4)18-15-21(26)23-19-14-17(2)11-12-20(19)25(5,6)27-22(23)16-18/h14-16,19-20H,7-13,26H2,1-6H3/t19-,20-/m1/s1 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 11.7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
AMRI
Curated by ChEMBL
| Assay Description Displacement of [3H]CP-55940 from CB1 receptor |
Bioorg Med Chem Lett 20: 1424-6 (2010)
Article DOI: 10.1016/j.bmcl.2009.12.092 BindingDB Entry DOI: 10.7270/Q2PC32GV |
More data for this Ligand-Target Pair | |