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SMILES: FC(CCn1cc(NC(=O)Cc2cccc(OC(F)(F)F)c2)nn1)Cn1cc(nn1)C(=O)NCc1cccc(OC(F)(F)F)c1

InChI Key: InChIKey=UEFQSWFMSOSYJP-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 405064   
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
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM405064
PNG
(1-[2-fluoro-4-(4-{2-[3- (trifluoromethoxy)phenyl]a...)
Show SMILES FC(CCn1cc(NC(=O)Cc2cccc(OC(F)(F)F)c2)nn1)Cn1cc(nn1)C(=O)NCc1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C26H23F7N8O4/c27-18(13-41-14-21(36-38-41)24(43)34-12-17-4-2-6-20(10-17)45-26(31,32)33)7-8-40-15-22(37-39-40)35-23(42)11-16-3-1-5-19(9-16)44-25(28,29)30/h1-6,9-10,14-15,18H,7-8,11-13H2,(H,34,43)(H,35,42)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a


TBA

Assay Description
The inhibition of purified recombinant human GAC by varying concentrations of inhibitors is assessed via a dual-coupled enzymatic assay. The glutamat...


Citation and Details

BindingDB Entry DOI: 10.7270/Q20Z76GP
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM405064
PNG
(1-[2-fluoro-4-(4-{2-[3- (trifluoromethoxy)phenyl]a...)
Show SMILES FC(CCn1cc(NC(=O)Cc2cccc(OC(F)(F)F)c2)nn1)Cn1cc(nn1)C(=O)NCc1cccc(OC(F)(F)F)c1
Show InChI InChI=1S/C26H23F7N8O4/c27-18(13-41-14-21(36-38-41)24(43)34-12-17-4-2-6-20(10-17)45-26(31,32)33)7-8-40-15-22(37-39-40)35-23(42)11-16-3-1-5-19(9-16)44-25(28,29)30/h1-6,9-10,14-15,18H,7-8,11-13H2,(H,34,43)(H,35,42)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<100n/an/an/an/an/an/a



The University of Texas System

US Patent


Assay Description
The inhibition of purified recombinant human GAC by varying concentrations of inhibitors is assessed via a dual-coupled enzymatic assay. The glutamat...


US Patent US10344025 (2019)


BindingDB Entry DOI: 10.7270/Q2765HQC
More data for this
Ligand-Target Pair