Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RARB | P10826 | 8/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.33 |
| ▸ | PTGS1 | P23219 | 4/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.33 |
| ▸ | SNCA | P37840 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | DRD3 | P35462 | 2/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NR2E1 | Q9Y466 | 1/20 | 0.33 |
| ▸ | SLCO1B3 | Q9NPD5 | 1/20 | 0.33 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.33 |
| ▸ | RXRA | P19793 | 8/20 | 0.33 |
| ▸ | RARA | P10276 | 7/20 | 0.33 |
| ▸ | RARG | P13631 | 7/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13950640 | 0.78 | KRAS (0.39) | RARBCYP1A2HAO1ALDH1A1CYP3A4 | |
| SCHEMBL9580605 | 0.78 | RARB (0.38) | RARBCYP1A2HAO1ALDH1A1CYP3A4 | |
| SCHEMBL5267535 | 0.78 | RARB (0.38) | RARBCYP1A2HAO1ALDH1A1CYP3A4 | |
| SCHEMBL6368904 | 0.75 | RARB (0.43) | RARBCYP1A2HAO1ALDH1A1PTGS1 | |
| SCHEMBL3346411 | 0.72 | RARB (0.41) | RARBCYP1A2ALDH1A1PTGS1LMNA | |
| SCHEMBL4495310 | 0.71 | CYP1A2 (0.44) | RARBCYP1A2HAO1ALDH1A1CYP3A4 | |
| SCHEMBL11412206 | 0.70 | RARB (0.42) | RARBCYP1A2ALDH1A1CYP3A4PTGS1 | |
| SCHEMBL10695190 | 0.70 | CYP1A2 (0.33) | CYP1A2 | |
| SCHEMBL5269834 | 0.67 | RARB (0.38) | RARBCYP1A2HAO1ALDH1A1PTGS1 | |
| SCHEMBL11875731 | 0.67 | CYP1A2 (0.40) | RARBCYP1A2HAO1ALDH1A1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0260472-B1 | METHOD FOR THE PRODUCTION OF CYCLOALIPHATIC KETONES | FIRMENICH SA (CH) | 1991-03-13 | — | — | EP | disclosed |