1682644-84-3
1682644-84-3
Chemical Structure
PAT-078
- CAS 番号: 1682644-84-3
- Formula:C25H16ClFN2O2
- Molecular Weight:430.86
IUPAC Name: (Z)-4-(2-(6-chloro-1-(4-fluorobenzyl)-1H-indol-3-yl)-1-cyanovinyl)benzoic acid
InChIKey: KOJRGZHWAHYXMU-YBFXNURJSA-N
SMILES: C(=C(\C#N)/C1=CC=C(C(O)=O)C=C1)\C=2C=3C(N(CC4=CC=C(F)C=C4)C2)=CC(Cl)=CC3
Biological Activity: PAT-078 is a type II autotaxin (ATX) inhibitor. PAT-078 mainly occupies the hydrophobic pocket of ATX, blocks the bottleneck region between the hydrophobic channel and the catalytic site, and does not interact with the zinc ion at the catalytic site[1].
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PAT-078 | PAT-078 is a type II autotaxin (ATX) inhibitor. PAT-078 mainly occupies the hydrophobic pocket of ATX, blocks the bottleneck region between the hydrophobic channel and the catalytic site, and does not interact with the zinc ion at the catalytic site. | |||||||||||||||||||||
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