BDBM50648278 CHEMBL5613488

SMILES COc1ccc(-c2cc(-c3ccc(O)cc3)nc(-c3ncccn3)n2)c(O)c1

InChI Key InChIKey=SLRNFRUKJNJOLS-UHFFFAOYSA-N

Data  3 IC50  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50648278   

TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Chongqing Medical University

Curated by ChEMBL
LigandPNGBDBM50648278(CHEMBL5613488)
Affinity DataIC50: 2.00E+4nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Chongqing Medical University

Curated by ChEMBL
LigandPNGBDBM50648278(CHEMBL5613488)
Affinity DataIC50: 90nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Chongqing Medical University

Curated by ChEMBL
LigandPNGBDBM50648278(CHEMBL5613488)
Affinity DataIC50: 79nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Chongqing Medical University

Curated by ChEMBL
LigandPNGBDBM50648278(CHEMBL5613488)
Affinity DataEC50:  279nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed
TargetIsocitrate dehydrogenase [NADP] cytoplasmic(Human)
Chongqing Medical University

Curated by ChEMBL
LigandPNGBDBM50648278(CHEMBL5613488)
Affinity DataEC50:  263nMMore data for this Ligand-Target Pair
Ligand Info
In Depth
Date in BDB:
10/12/2025
Entry Details
PubMed