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BDBM108983 US8604016, 565::US9938267, Cmpd ID 565

SMILES: Clc1ccccc1CC(=O)Nc1nnc(CCCCc2ccc(NC(=O)Cc3ccccc3Cl)nn2)s1

InChI Key: InChIKey=HHAWWXMTJXJCHP-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 108983   
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))
BDBM108983
PNG
(US8604016, 565 | US9938267, Cmpd ID 565)
Show SMILES Clc1ccccc1CC(=O)Nc1nnc(CCCCc2ccc(NC(=O)Cc3ccccc3Cl)nn2)s1
Show InChI InChI=1S/C26H24Cl2N6O2S/c27-20-10-4-1-7-17(20)15-23(35)29-22-14-13-19(31-32-22)9-3-6-12-25-33-34-26(37-25)30-24(36)16-18-8-2-5-11-21(18)28/h1-2,4-5,7-8,10-11,13-14H,3,6,9,12,15-16H2,(H,29,32,35)(H,30,34,36)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 5n/an/an/an/an/an/a



Calithera Biosciences, Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US9938267 (2018)

More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM108983
PNG
(US8604016, 565 | US9938267, Cmpd ID 565)
Show SMILES Clc1ccccc1CC(=O)Nc1nnc(CCCCc2ccc(NC(=O)Cc3ccccc3Cl)nn2)s1
Show InChI InChI=1S/C26H24Cl2N6O2S/c27-20-10-4-1-7-17(20)15-23(35)29-22-14-13-19(31-32-22)9-3-6-12-25-33-34-26(37-25)30-24(36)16-18-8-2-5-11-21(18)28/h1-2,4-5,7-8,10-11,13-14H,3,6,9,12,15-16H2,(H,29,32,35)(H,30,34,36)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 5n/an/an/an/an/an/a



Calithera Biosciences Inc.

US Patent


Assay Description
Compounds were assessed for their ability to inhibit the enzymatic activity of a recombinant form of Glutaminase 1 (GAC) using a biochemical assay th...


US Patent US8604016 (2013)


BindingDB Entry DOI: 10.7270/Q2CC0ZBW
More data for this
Ligand-Target Pair