DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Dual specificity protein kinase TTK
Ligand Name
~{N}-(2,6-diethylphenyl)-8-[[2-methoxy-4-(4-methylpiperazin-1-yl)phenyl]amino]-1-methyl-4,5-dihydropyrazolo[4,3-h]quinazoline-3-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
DHKBTAOKHPQHKT-UHFFFAOYSA-N
SMILES
CCc1cccc(c1NC(=O)c2c3c(n(n2)C)-c4c(cnc(n4)Nc5ccc(cc5OC)N6CCN(CC6)C)CC3)CC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5MRB
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Color Legend
Unassigned regionsLigand / hetero atomse5mrbA1
ECOD domains from experimental PDB structures interacting with ligand C5N
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P33981n/aC5N5mrbe5mrbA1A:514-795
P33981n/aC5N5o91e5o91A1A:514-796