Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.75 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.75 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.75 |
| ▸ | LMNA | P02545 | 2/20 | 0.75 |
| ▸ | HSPD1 | P10809 | 2/20 | 0.75 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.75 |
| ▸ | HSPE1 | P61604 | 2/20 | 0.75 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.75 |
| ▸ | AR | P10275 | 1/20 | 0.75 |
| ▸ | TSHR | P16473 | 1/20 | 0.75 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.75 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.75 |
| ▸ | USP2 | O75604 | 1/20 | 0.75 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.75 |
| ▸ | ESR1 | P03372 | 1/20 | 0.75 |
| ▸ | TST | Q16762 | 1/20 | 0.75 |
| ▸ | MAPT | P10636 | 3/20 | 0.68 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.68 |
| ▸ | SREBF1 | P36956 | 1/20 | 0.68 |
| ▸ | VDR | P11473 | 5/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL6651547 | 1.00 | ALDH1A1 (0.75) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL29768278 | 1.00 | ALDH1A1 (0.75) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL5917328 | 1.00 | ALDH1A1 (0.75) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL285664 | 1.00 | ALDH1A1 (0.75) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL285663 | 1.00 | ALDH1A1 (0.75) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL6651542 | 1.00 | ALDH1A1 (0.75) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL1249402 | 0.92 | ALDH1A1 (0.74) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL18393817 | 0.92 | ALDH1A1 (0.74) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL31602211 | 0.92 | ALDH1A1 (0.74) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 | |
| SCHEMBL19733279 | 0.92 | ALDH1A1 (0.74) | ALDH1A1ALOX15CYP3A4LMNAHSPD1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007006036-A2 | HYDROXYLATED FORMS OF ERGOSTEROLS AND ERGOCALCIFEROLS, DERIVATIVES THEREOF, METHODS OF PRODUCTION AND USES THEREOF | THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) | 2007-01-11 | — | — | WO | claimed |
| WO-2007006036-A2 | HYDROXYLATED FORMS OF ERGOSTEROLS AND ERGOCALCIFEROLS, DERIVATIVES THEREOF, METHODS OF PRODUCTION AND USES THEREOF | THE UNIVERSITY OF TENNESSEE RESEARCH FOUNDATION (US) | 2007-01-11 | — | — | WO | disclosed |