BDBM50364078 CHEMBL1950933
SMILES: CC(C)(C)c1nc2cc(ccc2n1CC1CCN(CC1)C=O)S(=O)(=O)c1nccs1
InChI Key: InChIKey=XLOZYEAFPMDCKC-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50364078 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)) | BDBM50364078
(CHEMBL1950933)Show SMILES CC(C)(C)c1nc2cc(ccc2n1CC1CCN(CC1)C=O)S(=O)(=O)c1nccs1 Show InChI InChI=1S/C21H26N4O3S2/c1-21(2,3)19-23-17-12-16(30(27,28)20-22-8-11-29-20)4-5-18(17)25(19)13-15-6-9-24(14-26)10-7-15/h4-5,8,11-12,14-15H,6-7,9-10,13H2,1-3H3 | 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 | 321 | 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 | |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM50364078
(CHEMBL1950933)Show SMILES CC(C)(C)c1nc2cc(ccc2n1CC1CCN(CC1)C=O)S(=O)(=O)c1nccs1 Show InChI InChI=1S/C21H26N4O3S2/c1-21(2,3)19-23-17-12-16(30(27,28)20-22-8-11-29-20)4-5-18(17)25(19)13-15-6-9-24(14-26)10-7-15/h4-5,8,11-12,14-15H,6-7,9-10,13H2,1-3H3 | 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 | 8.40 | 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 | |