BDBM50353088 CHEMBL1822942
SMILES: CCCCCc1cc2cc(C(=O)NCCc3ccc(F)cc3)c(=O)n(C)c2c(O)c1OC
InChI Key: InChIKey=CRPILUDAQQEGIJ-UHFFFAOYSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 2 hits for monomerid = 50353088 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)) | BDBM50353088
(CHEMBL1822942)Show SMILES CCCCCc1cc2cc(C(=O)NCCc3ccc(F)cc3)c(=O)n(C)c2c(O)c1OC Show InChI InChI=1S/C25H29FN2O4/c1-4-5-6-7-17-14-18-15-20(25(31)28(2)21(18)22(29)23(17)32-3)24(30)27-13-12-16-8-10-19(26)11-9-16/h8-11,14-15,29H,4-7,12-13H2,1-3H3,(H,27,30) | PDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 0.0430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Texas
Curated by ChEMBL
| Assay Description Binding affinity to CB2 receptor |
Bioorg Med Chem 19: 5698-707 (2011)
Article DOI: 10.1016/j.bmc.2011.07.062 BindingDB Entry DOI: 10.7270/Q2GH9JC3 |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 1
(Homo sapiens (Human)) | BDBM50353088
(CHEMBL1822942)Show SMILES CCCCCc1cc2cc(C(=O)NCCc3ccc(F)cc3)c(=O)n(C)c2c(O)c1OC Show InChI InChI=1S/C25H29FN2O4/c1-4-5-6-7-17-14-18-15-20(25(31)28(2)21(18)22(29)23(17)32-3)24(30)27-13-12-16-8-10-19(26)11-9-16/h8-11,14-15,29H,4-7,12-13H2,1-3H3,(H,27,30) | PDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| CHEMBL PC cid PC sid UniChem
Similars
| Article PubMed
| 8.64E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Texas
Curated by ChEMBL
| Assay Description Binding affinity to CB1 receptor |
Bioorg Med Chem 19: 5698-707 (2011)
Article DOI: 10.1016/j.bmc.2011.07.062 BindingDB Entry DOI: 10.7270/Q2GH9JC3 |
More data for this Ligand-Target Pair | |