Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.50 |
| ▸ | GAA | P10253 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.48 |
| ▸ | CA1 | P00915 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | TYR | P14679 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL26373519 | 0.93 | ALDH1A1 (0.53) | ALDH1A1GAATDP1CA2CA1 | |
| SCHEMBL18459329 | 0.88 | CA2 (0.61) | ALDH1A1GAATDP1CA2CA1 | |
| SCHEMBL9911752 | 0.82 | GAA (0.51) | ALDH1A1GAATSHRCYP3A4SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL10460314 | 0.82 | HTT (0.47) | ALDH1A1GAACA2CA1MEN1 | |
| SCHEMBL10461642 | 0.82 | NPC1 (0.53) | ALDH1A1GAATDP1SMN1; SMN2POLB | |
| SCHEMBL10463196 | 0.81 | PTGS1 (0.56) | ALDH1A1GAATDP1CA2CA1 | |
| SCHEMBL19985676 | 0.81 | ALDH1A1 (0.50) | ALDH1A1GAATDP1TSHRCYP3A4 | |
| SCHEMBL8971750 | 0.81 | GAA (0.51) | ALDH1A1GAATDP1SMN1; SMN2MEN1 | |
| SCHEMBL10365870 | 0.81 | CA2 (0.46) | ALDH1A1GAATDP1CA2CA1 | |
| SCHEMBL7701421 | 0.81 | AKR1C3 (0.57) | ALDH1A1GAATDP1SMN1; SMN2POLB |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0263229-A1 | Phenol derivatives, their preparation and the use thereof | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1988-04-13 | — | — | EP | claimed |
| EP-0211549-B1 | SUBSTITUTED DI-T-BUTYLPHENOLS | RIKER LABORATORIES, INC. (US) | 1990-12-27 | — | — | EP | disclosed |
| US-4906662-A | Phenol derivatives, their preparation and the use thereof | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1990-03-06 | — | — | US | disclosed |
| EP-0263229-A1 | Phenol derivatives, their preparation and the use thereof | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1988-04-13 | — | — | EP | disclosed |
| US-4716178-A | Substituted di-t-butylphenols | RIKER LABORATORIES, INC. (US) | 1987-12-29 | — | — | US | disclosed |
| EP-0211549-A2 | Substituted DI-t-butylphenols | RIKER LABORATORIES, INC. (US) | 1987-02-25 | — | — | EP | disclosed |