DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Serine/threonine-protein kinase Chk1
Ligand Name
2-[(2-methoxy-4-{[4-(4-methylpiperazin-1-yl)piperidin-1-yl]carbonyl}phenyl)amino]-5,11-dimethyl-5,11-dihydro-6H-pyrimido[4,5-b][1,4]benzodiazepin-6-one
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IWMCPJZTADUIFX-UHFFFAOYSA-N
SMILES
CN1CCN(CC1)C2CCN(CC2)C(=O)c3ccc(c(c3)OC)Nc4ncc5c(n4)N(c6ccccc6C(=O)N5C)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 5OOT
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Color Legend
Unassigned regionsLigand / hetero atomse5ootA1
ECOD domains from experimental PDB structures interacting with ligand 4K4
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
O14757n/a4K45oote5ootA1A:4-270
O14757n/a4K45oq5e5oq5A1A:3-270
O14757n/a4K45oq6e5oq6A1A:5-270