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BDBM50238203 CHEMBL4074218

SMILES: Cc1cc(\C=C2/SC(=O)NC2=O)c(C)n1-c1ccc(cc1)-c1ccc(\C=C2/SC(=O)NC2=O)c(Cl)c1

InChI Key: InChIKey=PUKMEKVQVLYPHD-IINORCHSSA-N

Data: 3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50238203   
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))
BDBM50238203
PNG
(CHEMBL4074218)
Show SMILES Cc1cc(\C=C2/SC(=O)NC2=O)c(C)n1-c1ccc(cc1)-c1ccc(\C=C2/SC(=O)NC2=O)c(Cl)c1
Show InChI InChI=1S/C26H18ClN3O4S2/c1-13-9-18(12-22-24(32)29-26(34)36-22)14(2)30(13)19-7-5-15(6-8-19)16-3-4-17(20(27)10-16)11-21-23(31)28-25(33)35-21/h3-12H,1-2H3,(H,28,31,33)(H,29,32,34)/b21-11-,22-12-
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 255n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of recombinant human MCF7 cells derived His-tagged GAC (L123 to S598 residues) expressed in Escherichia coli C41(DE3)pLysS using glutamine...


J Med Chem 60: 5599-5612 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00282
BindingDB Entry DOI: 10.7270/Q26H4KP5
More data for this
Ligand-Target Pair
Glutaminase liver isoform, mitochondrial


(Homo sapiens)
BDBM50238203
PNG
(CHEMBL4074218)
Show SMILES Cc1cc(\C=C2/SC(=O)NC2=O)c(C)n1-c1ccc(cc1)-c1ccc(\C=C2/SC(=O)NC2=O)c(Cl)c1
Show InChI InChI=1S/C26H18ClN3O4S2/c1-13-9-18(12-22-24(32)29-26(34)36-22)14(2)30(13)19-7-5-15(6-8-19)16-3-4-17(20(27)10-16)11-21-23(31)28-25(33)35-21/h3-12H,1-2H3,(H,28,31,33)(H,29,32,34)/b21-11-,22-12-
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.19E+3n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His-tagged GAB (P56 to V602 residues) expressed in Escherichia coli C41(DE3)pLysS using glutamine as substrate preinc...


J Med Chem 60: 5599-5612 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00282
BindingDB Entry DOI: 10.7270/Q26H4KP5
More data for this
Ligand-Target Pair
Glutaminase kidney isoform, mitochondrial


(Homo sapiens (Human))
BDBM50238203
PNG
(CHEMBL4074218)
Show SMILES Cc1cc(\C=C2/SC(=O)NC2=O)c(C)n1-c1ccc(cc1)-c1ccc(\C=C2/SC(=O)NC2=O)c(Cl)c1
Show InChI InChI=1S/C26H18ClN3O4S2/c1-13-9-18(12-22-24(32)29-26(34)36-22)14(2)30(13)19-7-5-15(6-8-19)16-3-4-17(20(27)10-16)11-21-23(31)28-25(33)35-21/h3-12H,1-2H3,(H,28,31,33)(H,29,32,34)/b21-11-,22-12-
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 57n/an/an/an/an/an/a



National Health Research Institutes

Curated by ChEMBL


Assay Description
Inhibition of recombinant human His-tagged KGA (L123 to L669 residues) expressed in Escherichia coli BL21(DE3)pLysS using glutamine substrate preincu...


J Med Chem 60: 5599-5612 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00282
BindingDB Entry DOI: 10.7270/Q26H4KP5
More data for this
Ligand-Target Pair