BindingDB logo
myBDB logout

BDBM339750 US10202339, Compound 195

SMILES: CCS(=O)c1ccc(cc1NC(=O)Nc1cccc(c1)C(F)(F)F)S(=O)(=O)NCC(F)(F)F

InChI Key: InChIKey=QXCDDTBQAIPTKQ-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 339750   
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))
BDBM339750
PNG
(US10202339, Compound 195)
Show SMILES CCS(=O)c1ccc(cc1NC(=O)Nc1cccc(c1)C(F)(F)F)S(=O)(=O)NCC(F)(F)F
Show InChI InChI=1S/C18H17F6N3O4S2/c1-2-32(29)15-7-6-13(33(30,31)25-10-17(19,20)21)9-14(15)27-16(28)26-12-5-3-4-11(8-12)18(22,23)24/h3-9,25H,2,10H2,1H3,(H2,26,27,28)
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