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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'IDH2(R140Q)' and Ligand = 'BDBM339766'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
IDH2(R140Q)


(Homo sapiens (Human))
BDBM339766
PNG
(US10202339, Compound 359)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2cc(ccc2-c2nccs2)S(=O)(=O)Nc2ccccc2)c1
Show InChI InChI=1S/C23H17F3N4O3S2/c24-23(25,26)15-5-4-8-17(13-15)28-22(31)29-20-14-18(9-10-19(20)21-27-11-12-34-21)35(32,33)30-16-6-2-1-3-7-16/h1-14,30H,(H2,28,29,31)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 550n/an/an/an/an/an/a



Agios Pharmaceuticals, Inc.

US Patent


Assay Description
Compounds were assayed for IDH2 R140Q inhibitory activity through a cofactor depletion assay. Compounds were preincubated with enzyme, then the react...


US Patent US10202339 (2019)

More data for this
Ligand-Target Pair