DrugDomain logoDrugDomain

Attributes

UniProt ID
Protein Name
Autotaxin
Ligand Name
(3,5-dichlorophenyl)methyl 4-[3-oxo-3-(2-oxo-2,3-dihydro-1,3-benzoxazol-6-yl)propyl]piperazine-1-carboxylate
DrugBank ID
None
PDB Ligand Accession
ChEMBL ID
n/a
PubChem ID
n/a
InChIKey
JMSUDQYHPSNBSN-UHFFFAOYSA-N
SMILES
c1cc2c(cc1C(=O)CCN3CCN(CC3)C(=O)OCc4cc(cc(c4)Cl)Cl)OC(=O)N2
Drug Action
No data available
Affinity Metrics
No affinity data available

3D Structure

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

Structure: 5L0K
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Color Legend
Unassigned regionsLigand / hetero atomse5l0kA1e5l0kA2e5l0kA3e5l0kA4e5l0kA5e5l0kB1e5l0kB3e5l0kB4e5l0kB5e5l0kB6
ECOD domains from experimental PDB structures interacting with ligand 6ZO
UniProtDrugBankPDB LigandPDB IDECOD DomainRange Definition
Q64610n/a6ZO5l0ke5l0kA2A:140-365,A:473-539
Q64610n/a6ZO5l0ke5l0kA4A:366-477
Q64610n/a6ZO5l0ke5l0kB5B:536-569,B:591-859
Q64610n/a6ZO5l0ke5l0kB6B:138-368,B:471-539
Q64610n/a6ZO5s9le5s9lA3A:138-368,A:471-539