BDBM50306532 1-methyl-3-(6aR,10aR)-6,6,9-trimethyl-3-(2-methyloctan-2-yl)-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-yl)urea::CHEMBL600396
SMILES: CCCCCCC(C)(C)c1cc(NC(=O)NC)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1
InChI Key: InChIKey=YRIFMORIZIRKHD-NHCUHLMSSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50306532 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)) | BDBM50306532
(1-methyl-3-(6aR,10aR)-6,6,9-trimethyl-3-(2-methylo...)Show SMILES CCCCCCC(C)(C)c1cc(NC(=O)NC)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1 |r,t:19| Show InChI InChI=1S/C27H42N2O2/c1-8-9-10-11-14-26(3,4)19-16-22(29-25(30)28-7)24-20-15-18(2)12-13-21(20)27(5,6)31-23(24)17-19/h15-17,20-21H,8-14H2,1-7H3,(H2,28,29,30)/t20-,21-/m1/s1 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 257 | 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)) | BDBM50306532
(1-methyl-3-(6aR,10aR)-6,6,9-trimethyl-3-(2-methylo...)Show SMILES CCCCCCC(C)(C)c1cc(NC(=O)NC)c2[C@@H]3C=C(C)CC[C@H]3C(C)(C)Oc2c1 |r,t:19| Show InChI InChI=1S/C27H42N2O2/c1-8-9-10-11-14-26(3,4)19-16-22(29-25(30)28-7)24-20-15-18(2)12-13-21(20)27(5,6)31-23(24)17-19/h15-17,20-21H,8-14H2,1-7H3,(H2,28,29,30)/t20-,21-/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
| 333 | 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 | |