DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Isocitrate dehydrogenase cytoplasmic -specific ICDH
Ligand Name
(E)-1-benzyl-5-((1-methyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl)pyridin-2(1H)-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
ORESZEYKAHLKRD-NTEUORMPSA-N
SMILES
CN1C(=O)C(=CC2=CN(C(=O)C=C2)Cc3ccccc3)NC1=S
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4XS3
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Color Legend
Unassigned regionsLigand / hetero atomse4xs3A1e4xs3A2e4xs3B1e4xs3B2
ECOD domains from experimental PDB structures interacting with ligand 42W
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O75874n/a42W4xs3e4xs3A1A:3-105,A:287-412
O75874n/a42W4xs3e4xs3A2A:106-286
O75874n/a42W4xs3e4xs3B1B:106-286
O75874n/a42W4xs3e4xs3B2B:4-105,B:287-413