BDBM50522839 CHEMBL2095003::DNDI1417825

SMILES CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C(N1CCOCC1)c1ccccn1

InChI Key InChIKey=FHIRILMXIWNDLT-UHFFFAOYSA-N

Data  3 IC50  3 Kd

  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 6 hits for monomerid = 50522839   

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

Curated by ChEMBL
LigandPNGBDBM50522839(CHEMBL2095003 | DNDI1417825)
Affinity DataIC50:  4.37E+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 DepthDetails ArticlePubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Homo sapiens (Human))
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522839(CHEMBL2095003 | DNDI1417825)
Affinity DataKd:  3.80E+3nMAssay Description:Binding affinity to N-terminal 6-His-tagged IDH1 R132H mutant (unknown origin) expressed in BL21 cells assessed as equilibrium dissociation constant ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Homo sapiens (Human))
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522839(CHEMBL2095003 | DNDI1417825)
Affinity DataKd:  720nMAssay Description:Binding affinity to N-terminal 6-His-tagged IDH1 R132C mutant (unknown origin) expressed in BL21 cells assessed as equilibrium dissociation constant ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Homo sapiens (Human))
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522839(CHEMBL2095003 | DNDI1417825)
Affinity DataIC50:  410nMAssay 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 DepthDetails ArticlePubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Homo sapiens (Human))
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522839(CHEMBL2095003 | DNDI1417825)
Affinity DataIC50:  2.70E+3nMAssay 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 DepthDetails ArticlePubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Homo sapiens (Human))
Huazhong Agricultural University

Curated by ChEMBL
LigandPNGBDBM50522839(CHEMBL2095003 | DNDI1417825)
Affinity DataKd: >5.00E+4nMAssay Description:Binding affinity to N-terminal 6-His-tagged wild type IDH1 (unknown origin) expressed in BL21 cells assessed as equilibrium dissociation constant by ...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed