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BDBM339595 US10202339, Compound 39

SMILES: Fc1ccc(NC(=O)Nc2cc(ccc2-c2ccccc2)S(=O)(=O)NCC(F)(F)F)cc1

InChI Key: InChIKey=DKJRPANGBCOIAZ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 339595   
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
IDH2(R140Q)


(Homo sapiens (Human))
BDBM339595
PNG
(US10202339, Compound 39)
Show SMILES Fc1ccc(NC(=O)Nc2cc(ccc2-c2ccccc2)S(=O)(=O)NCC(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N3O3S/c22-15-6-8-16(9-7-15)27-20(29)28-19-12-17(32(30,31)26-13-21(23,24)25)10-11-18(19)14-4-2-1-3-5-14/h1-12,26H,13H2,(H2,27,28,29)
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