DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Autotaxin
Ligand Name
3-({6-chloro-7-fluoro-2-methyl-1-[2-oxo-2-(spiro[cyclopropane-1,3'-indol]-1'(2'H)-yl)ethyl]-1H-indol-3-yl}sulfanyl)-2-fluorobenzoic acid
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
YFALJJNRFPFPRE-UHFFFAOYSA-N
SMILES
Cc1c(c2ccc(c(c2n1CC(=O)N3CC4(CC4)c5c3cccc5)F)Cl)Sc6cccc(c6F)C(=O)O
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 4ZG7
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Color Legend
Unassigned regionsLigand / hetero atomse4zg7A1e4zg7A2e4zg7A3e4zg7A5e4zg7A6
ECOD domains from experimental PDB structures interacting with ligand 4O0
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q13822n/a4O04zg7e4zg7A3A:55-96
Q13822n/a4O04zg7e4zg7A6A:139-369,A:472-540