Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | BTN3A1 | O00481 | 1/20 | 0.34 |
| ▸ | MVD | P53602 | 2/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8837386 | 0.90 | BTN3A1 (0.39) | ALDH1A1BTN3A1MVDPPARD | |
| SCHEMBL11258450 | 0.90 | ALDH1A1 (0.45) | ALDH1A1BTN3A1 | |
| SCHEMBL9064989 | 0.86 | ALDH1A1 (0.50) | ALDH1A1BTN3A1PPARD | |
| SCHEMBL10694319 | 0.81 | PPARD (0.39) | BTN3A1MVDPPARD | |
| SCHEMBL17488889 | 0.79 | BTN3A1 (0.43) | BTN3A1MVDPPARD | |
| Di(Hydroxyethyl)Ether SCHEMBL6401383 | 0.78 | ALDH1A1 (0.46) | ALDH1A1PPARD | |
| SCHEMBL9117167 | 0.78 | CYP3A4 (0.38) | ALDH1A1BTN3A1MVDPPARD | |
| SCHEMBL2688807 | 0.77 | ALDH1A1 (0.64) | ALDH1A1BTN3A1MVD | |
| SCHEMBL4648152 | 0.77 | BTN3A1 (0.53) | ALDH1A1BTN3A1MVD | |
| SCHEMBL4906432 | 0.76 | ALDH1A1 (0.60) | ALDH1A1BTN3A1MVD |
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-5106883-A | Used to produce fire retardent polyurethane foams | CHEMIE LINZ GESELLSCHAFT M.B.H. (AT) | 1992-04-21 | — | — | US | disclosed |