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BDBM50329141 1,1,1-trifluoro-N-((1-(1-(2-fluorophenylsulfonyl)-1H-indol-2-ylsulfonyl)-3,3-dimethylpiperidin-4-yl)methyl)methanesulfonamide::CHEMBL1270193

SMILES: CC1(C)CN(CCC1CNS(=O)(=O)C(F)(F)F)S(=O)(=O)c1cc2ccccc2n1S(=O)(=O)c1ccccc1F

InChI Key: InChIKey=LDUJMRHXJPYKFT-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50329141   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50329141
PNG
(1,1,1-trifluoro-N-((1-(1-(2-fluorophenylsulfonyl)-...)
Show SMILES CC1(C)CN(CCC1CNS(=O)(=O)C(F)(F)F)S(=O)(=O)c1cc2ccccc2n1S(=O)(=O)c1ccccc1F
Show InChI InChI=1S/C23H25F4N3O6S3/c1-22(2)15-29(12-11-17(22)14-28-39(35,36)23(25,26)27)38(33,34)21-13-16-7-3-5-9-19(16)30(21)37(31,32)20-10-6-4-8-18(20)24/h3-10,13,17,28H,11-12,14-15H2,1-2H3
PDB

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PC cid
PC sid
UniChem
Article
PubMed
4.20n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of beta-arrestin binding to recombinant cannabinoid CB2 receptor


Bioorg Med Chem Lett 20: 6785-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.08.126
BindingDB Entry DOI: 10.7270/Q26Q1XGJ
More data for this
Ligand-Target Pair