DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Epithelial discoidin domain-containing receptor 1
Ligand Name
(4~{S})-4-methyl-~{N}-[3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)phenyl]-2-pyrimidin-5-yl-3,4-dihydro-1~{H}-isoquinoline-7-carboxamide
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YXESXLYKZKCWFJ-LJQANCHMSA-N
SMILES
CC1CN(Cc2c1ccc(c2)C(=O)Nc3cc(cc(c3)C(F)(F)F)CN4CCN(CC4)C)c5cncnc5
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

Interactive Mol* view for the current protein-molecule pair.

Structure: 5FDP
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Color Legend
Unassigned regionsLigand / hetero atomse5fdpA1
ECOD domains from experimental PDB structures interacting with ligand 5WR
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q08345n/a5WR5fdpe5fdpA1A:604-912