BDBM50522844 CHEMBL4464973

SMILES CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(N1CCN(CC2CC2)CC1)c1ccccn1

InChI Key InChIKey=SIRLUGBOFZZNOC-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50522844   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522844(CHEMBL4464973)
Affinity DataIC50: 5.00E+4nMAssay Description:Inhibition of N-terminal 6-His-tagged IDH1 R132H mutant (unknown origin) expressed in Escherichia coli BL21 cells using alpha-KG as substrate in pres...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522844(CHEMBL4464973)
Affinity DataIC50: 1.80E+4nMAssay Description:Inhibition of N-terminal 6-His-tagged IDH1 R132C mutant (unknown origin) expressed in Escherichia coli BL21 cells using alpha-KG as substrate in pres...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522844(CHEMBL4464973)
Affinity DataIC50: 3.10E+4nMAssay Description:Inhibition of N-terminal 6-His-tagged wild type IDH1 (unknown origin) expressed in Escherichia coli BL21 cells using alpha-KG as substrate in presenc...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/24/2021
Entry Details Article
PubMed