BindingDB logo
myBDB logout

BDBM339687 US10202339, Compound 132

SMILES: FC(F)(F)c1cccc(NC(=O)Nc2cc(ccc2-c2ccsc2)S(=O)(=O)NC2CCOCC2)c1

InChI Key: InChIKey=YZFSAZOWMHTJSD-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 = 339687   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
IDH2(R140Q)


(Homo sapiens (Human))
BDBM339687
PNG
(US10202339, Compound 132)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2cc(ccc2-c2ccsc2)S(=O)(=O)NC2CCOCC2)c1
Show InChI InChI=1S/C23H22F3N3O4S2/c24-23(25,26)16-2-1-3-18(12-16)27-22(30)28-21-13-19(4-5-20(21)15-8-11-34-14-15)35(31,32)29-17-6-9-33-10-7-17/h1-5,8,11-14,17,29H,6-7,9-10H2,(H2,27,28,30)
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)


BindingDB Entry DOI: 10.7270/Q25M67VR
More data for this
Ligand-Target Pair