Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | ACLY | P53396 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL10635014 | 0.77 | ATR (0.31) | — | |
| SCHEMBL10892306 | 0.76 | ALDH1A1 (0.55) | ALDH1A1L3MBTL1THRBACLYTSHR | |
| SCHEMBL10496176 | 0.75 | CA1 (0.30) | — | |
| SCHEMBL10888075 | 0.75 | — | — | |
| SCHEMBL17264816 | 0.75 | ALDH1A1 (0.33) | ALDH1A1L3MBTL1THRB | |
| Fluoride SCHEMBL8763508 | 0.74 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1THRBACLY | |
| Hydrochloric Acid SCHEMBL10886179 | 0.73 | ALDH1A1 (0.36) | ALDH1A1L3MBTL1THRBACLY | |
| SCHEMBL10496100 | 0.73 | F2 (0.32) | ALDH1A1L3MBTL1 | |
| SCHEMBL28980551 | 0.72 | ALDH1A1 (0.57) | ALDH1A1L3MBTL1THRBTSHR | |
| SCHEMBL302404 | 0.70 | ALDH1A1 (0.42) | ALDH1A1L3MBTL1TSHR |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4851161-A | β-substituted polyfluoropropionate salts and derivatives | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1989-07-25 | — | — | US | disclosed |
| US-4474700-A | β-Substituted polyfluoropropionate salts and derivatives | E. I. Du Pont DeNemours and Company (US) | 1984-10-02 | — | — | US | disclosed |
| EP-0070635-A2 | Beta-substituted polyfluoropropionate salts and derivatives | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1983-01-26 | — | — | EP | disclosed |