Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.30 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.30 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL8048051 | 0.89 | PTGS1 (0.32) | ALDH1A1PTGS1PTGS2 | |
| SCHEMBL8042253 | 0.81 | ALDH1A1 (0.36) | ALDH1A1 | |
| SCHEMBL8032529 | 0.80 | GAA (0.36) | ALDH1A1PTGS1PTGS2 | |
| SCHEMBL8032871 | 0.79 | FBP1 (0.40) | ALDH1A1PTGS1PTGS2 | |
| SCHEMBL8033002 | 0.77 | PTGS1 (0.33) | ALDH1A1PTGS1PTGS2 | |
| SCHEMBL8050229 | 0.77 | PTGS1 (0.30) | PTGS1PTGS2 | |
| SCHEMBL8042342 | 0.75 | PTGS1 (0.33) | ALDH1A1PTGS1PTGS2 | |
| SCHEMBL8046779 | 0.75 | — | — | |
| SCHEMBL8032336 | 0.74 | PTGS1 (0.32) | PTGS1PTGS2 | |
| SCHEMBL8046531 | 0.73 | PTGS1 (0.32) | PTGS1PTGS2 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6080772-A | 2-AMINOTHIAZOLE TRIAZOLE OR TETRAZOLE COMPOUND FOR REGULATING PROTEIN TYROSINE PHOSPHATASE ACTIVITY | SUGEN, INC. (US) | 2000-06-27 | — | — | US | disclosed |