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Attributes

UniProt ID
Protein Name
Dipeptidyl peptidase 4
Ligand Name
2-[3-(aminomethyl)-4-(2,4-dichlorophenyl)-2-methyl-5-oxo-5,7-dihydro-6H-pyrrolo[3,4-b]pyridin-6-yl]-N,N-dimethylacetamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
PECDPZCIECMGCM-UHFFFAOYSA-N
SMILES
Cc1c(c(c2c(n1)CN(C2=O)CC(=O)N(C)C)c3ccc(cc3Cl)Cl)CN
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4JH0
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Color Legend
Unassigned regionsLigand / hetero atomse4jh0A1e4jh0A2e4jh0B1e4jh0B2
ECOD domains from experimental PDB structures interacting with ligand 1MD
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
P27487n/a1MD4jh0e4jh0A1A:39-508
P27487n/a1MD4jh0e4jh0A2A:509-766
P27487n/a1MD4jh0e4jh0B1B:39-508
P27487n/a1MD4jh0e4jh0B2B:509-766