DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Receptor-interacting serine/threonine-protein kinase 1
Ligand Name
1-{(3S,3aS)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-8-methoxy-3,3a,4,5-tetrahydro-2H-benzo[g]indazol-2-yl}-2-hydroxyethanone
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
RPGVJSZQQKMKSB-JLTOFOAXSA-N
SMILES
COc1ccc2c(c1)C3=NN(C(C3CC2)c4ccc(c(c4)F)OC(F)(F)F)C(=O)CO
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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Structure: 4ITI
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Color Legend
Unassigned regionsLigand / hetero atomse4itiA2e4itiB2
ECOD domains from experimental PDB structures interacting with ligand 1HW
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q13546n/a1HW4itie4itiA2A:8-294
Q13546n/a1HW4itie4itiB2B:7-294