DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Aurora kinase A
Ligand Name
N-[(3E)-5-[(2R)-2-METHOXY-2-PHENYLACETYL]PYRROLO[3,4-C]PYRAZOL-3(5H)-YLIDENE]-4-(4-METHYLPIPERAZIN-1-YL)BENZAMIDE
DrugBank ID
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
XKFTZKGMDDZMJI-HSZRJFAPSA-N
SMILES
CN1CCN(CC1)c2ccc(cc2)C(=O)Nc3c4c([nH]n3)CN(C4)C(=O)C(c5ccccc5)OC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 2J50
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Color Legend
Unassigned regionsLigand / hetero atomse2j50A1e2j50B1
ECOD domains from experimental PDB structures interacting with ligand DB11778
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O14965DB117786272j50e2j50A1A:128-388
O14965DB117786272j50e2j50B1B:128-388
O14965DB117786278ssoe8ssoA1A:127-389
O14965DB117786278ssoe8ssoD1D:127-389
O14965DB117786278sspe8sspA1A:126-389