DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Dual specificity protein kinase TTK
Ligand Name
N-(2,6-DIETHYLPHENYL)-1-METHYL-8-({4-[(1-METHYLPIPERIDIN-4-YL)CARBAMOYL]-2-(TRIFLUOROMETHOXY)PHENYL}AMINO)-4,5-DIHYDRO-1H-PYRAZOLO[4,3-H]QUINAZOLINE-3-CARBOXAMIDE
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JFOAJUGFHDCBJJ-UHFFFAOYSA-N
SMILES
CCc1cccc(c1NC(=O)c2c3c(n(n2)C)-c4c(cnc(n4)Nc5ccc(cc5OC(F)(F)F)C(=O)NC6CCN(CC6)C)CC3)CC
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 2X9E
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Color Legend
Unassigned regionsLigand / hetero atomse2x9eA1
ECOD domains from experimental PDB structures interacting with ligand SVE
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P33981n/aSVE2x9ee2x9eA1A:515-795
P33981n/aSVE5ap7e5ap7A1A:509-794
P33981n/aSVE5ntte5nttA1A:511-797