DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Cyclin-dependent kinase 12
Ligand Name
(2~{R})-2-[[6-[3-(3-methylphenyl)propylamino]-9-propan-2-yl-purin-2-yl]amino]butan-1-ol
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
IAQVCGQJJMTIMM-GOSISDBHSA-N
SMILES
CCC(CO)Nc1nc(c2c(n1)n(cn2)C(C)C)NCCCc3cccc(c3)C
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 8BUP
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Color Legend
Unassigned regionsLigand / hetero atomse8bupA1e8bupA2e8bupA3e8bupB1e8bupC1e8bupC2e8bupD1e8bupD2e8bupD3e8bupE1e8bupF1e8bupF2e8bupG1e8bupG2e8bupG3e8bupH1e8bupI1e8bupI2
ECOD domains from experimental PDB structures interacting with ligand RWN
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q9NYV4n/aRWN8bupe8bupB1B:715-1027
Q9NYV4n/aRWN8bupe8bupE1E:715-1027
Q9NYV4n/aRWN8bupe8bupH1H:715-1028