DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Menin
Ligand Name
1-[(2S)-2,3-dihydroxypropyl]-5-[(4-{[6-(2,2,2-trifluoroethyl)thieno[2,3-d]pyrimidin-4-yl]amino}piperidin-1-yl)methyl]-1 H-indole-2-carbonitrile
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
KCTFIWDZXROTJT-FQEVSTJZSA-N
SMILES
c1cc2c(cc1CN3CCC(CC3)Nc4c5cc(sc5ncn4)CC(F)(F)F)cc(n2CC(CO)O)C#N
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5DB0
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Color Legend
Unassigned regionsLigand / hetero atomse5db0A1e5db0A2
ECOD domains from experimental PDB structures interacting with ligand 58P
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O00255n/a58P5db0e5db0A1A:2-230
O00255n/a58P5db0e5db0A2A:231-589