BDBM50364093 CHEMBL1950840
SMILES: CC(C)(C)c1nc2cc(ccc2n1CC1CCN(CC1)C(=O)C(F)(F)F)S(=O)(=O)CCCC(F)(F)F
InChI Key: InChIKey=OMBJIPQFOFIAMF-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50364093 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)) | BDBM50364093
(CHEMBL1950840)Show SMILES CC(C)(C)c1nc2cc(ccc2n1CC1CCN(CC1)C(=O)C(F)(F)F)S(=O)(=O)CCCC(F)(F)F Show InChI InChI=1S/C23H29F6N3O3S/c1-21(2,3)19-30-17-13-16(36(34,35)12-4-9-22(24,25)26)5-6-18(17)32(19)14-15-7-10-31(11-8-15)20(33)23(27,28)29/h5-6,13,15H,4,7-12,14H2,1-3H3 | PDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | 23 | n/a | n/a | n/a | n/a |
Janssen Research& Development
Curated by ChEMBL
| Assay Description Agonist activity at human CB2 receptor |
Bioorg Med Chem Lett 22: 547-52 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.091 BindingDB Entry DOI: 10.7270/Q2JW8FBF |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50364093
(CHEMBL1950840)Show SMILES CC(C)(C)c1nc2cc(ccc2n1CC1CCN(CC1)C(=O)C(F)(F)F)S(=O)(=O)CCCC(F)(F)F Show InChI InChI=1S/C23H29F6N3O3S/c1-21(2,3)19-30-17-13-16(36(34,35)12-4-9-22(24,25)26)5-6-18(17)32(19)14-15-7-10-31(11-8-15)20(33)23(27,28)29/h5-6,13,15H,4,7-12,14H2,1-3H3 | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Patents
Similars
| Article PubMed
| n/a | n/a | n/a | n/a | >1.00E+4 | n/a | n/a | n/a | n/a |
Janssen Research& Development
Curated by ChEMBL
| Assay Description Agonist activity at human CB1 receptor |
Bioorg Med Chem Lett 22: 547-52 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.091 BindingDB Entry DOI: 10.7270/Q2JW8FBF |
More data for this Ligand-Target Pair | |