Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 2' and Ligand = 'BDBM135902' Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kJ/mole | IC50 nM | Kd nM | EC50/IC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
Cannabinoid receptor 2
(Homo sapiens (Human)) | BDBM135902
(US8859596, 190)Show SMILES CCCCn1nc(s\c1=N/C(=O)c1cc(ccc1ON=C1CCCC1)C(F)(F)F)C(C)(C)C |(-13.64,9.8,;-12.5,8.77,;-11.03,9.24,;-10.71,10.75,;-9.25,11.23,;-8.77,12.69,;-7.23,12.69,;-6.76,11.23,;-8,10.32,;-8,8.78,;-6.67,8.01,;-5.33,8.78,;-6.67,6.47,;-8,5.7,;-8,4.16,;-6.67,3.39,;-5.33,4.16,;-5.33,5.7,;-4,6.47,;-2.67,5.7,;-2.67,4.16,;-1.42,3.25,;-1.9,1.79,;-3.44,1.79,;-3.91,3.25,;-9.34,3.39,;-10.67,2.62,;-10.11,4.72,;-8.57,2.06,;-6.33,13.94,;-5.42,15.18,;-5.08,13.03,;-7.57,14.84,)| Show InChI InChI=1S/C23H29F3N4O2S/c1-5-6-13-30-21(33-20(28-30)22(2,3)4)27-19(31)17-14-15(23(24,25)26)11-12-18(17)32-29-16-9-7-8-10-16/h11-12,14H,5-10,13H2,1-4H3/b27-21- | PDB
Reactome pathway KEGG
UniProtKB/SwissProt UniProtKB/TrEMBL
DrugBank antibodypedia GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| 1.70 | -50.9 | n/a | n/a | n/a | n/a | n/a | 7.4 | 30 |
AbbVie Inc.
US Patent
| Assay Description HEK293 cells stably expressing human CB2 receptors were grown until a confluent monolayer was formed. Briefly, the cells were harvested and homogeniz... |
US Patent US8859596 (2014)
BindingDB Entry DOI: 10.7270/Q2W66JHC |
More data for this Ligand-Target Pair | |
Cannabinoid receptor 2
(Rattus norvegicus (Rat)) | BDBM135902
(US8859596, 190)Show SMILES CCCCn1nc(s\c1=N/C(=O)c1cc(ccc1ON=C1CCCC1)C(F)(F)F)C(C)(C)C |(-13.64,9.8,;-12.5,8.77,;-11.03,9.24,;-10.71,10.75,;-9.25,11.23,;-8.77,12.69,;-7.23,12.69,;-6.76,11.23,;-8,10.32,;-8,8.78,;-6.67,8.01,;-5.33,8.78,;-6.67,6.47,;-8,5.7,;-8,4.16,;-6.67,3.39,;-5.33,4.16,;-5.33,5.7,;-4,6.47,;-2.67,5.7,;-2.67,4.16,;-1.42,3.25,;-1.9,1.79,;-3.44,1.79,;-3.91,3.25,;-9.34,3.39,;-10.67,2.62,;-10.11,4.72,;-8.57,2.06,;-6.33,13.94,;-5.42,15.18,;-5.08,13.03,;-7.57,14.84,)| Show InChI InChI=1S/C23H29F3N4O2S/c1-5-6-13-30-21(33-20(28-30)22(2,3)4)27-19(31)17-14-15(23(24,25)26)11-12-18(17)32-29-16-9-7-8-10-16/h11-12,14H,5-10,13H2,1-4H3/b27-21- | PDB
KEGG
UniProtKB/SwissProt
GoogleScholar AffyNet
| PC cid PC sid UniChem
Similars
| US Patent
| 3.20 | n/a | n/a | n/a | n/a | n/a | n/a | 7.4 | n/a |
AbbVie Inc.
US Patent
| Assay Description HEK293 cells stably expressing rat CB2 receptors were grown until a confluent monolayer was formed. Briefly, the cells were harvested and homogenized... |
US Patent US8859596 (2014)
BindingDB Entry DOI: 10.7270/Q2W66JHC |
More data for this Ligand-Target Pair | |