Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.32 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.32 |
| ▸ | CRHBP | P24387 | 1/20 | 0.32 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.32 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.32 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | BLM | P54132 | 2/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NPC1 | O15118 | 1/20 | 0.30 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.30 |
| ▸ | GMNN | O75496 | 1/20 | 0.30 |
| ▸ | USP2 | O75604 | 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 | |
|---|---|---|---|---|
| SCHEMBL7144907 | 0.81 | PPARG (0.44) | CYP3A4CYP2C19ALDH1A1KCNH2 | |
| SCHEMBL13772538 | 0.73 | ALDH1A1 (0.36) | CYP3A4CYP2C19ALDH1A1RIPK1SLC6A2 | |
| SCHEMBL6055204 | 0.72 | ALDH1A1 (0.39) | CYP3A4CYP2C19ALDH1A1RIPK1TSHR | |
| SCHEMBL3369244 | 0.70 | CYP3A4 (0.61) | CYP3A4CYP2C19ALDH1A1TSHRLMNA | |
| SCHEMBL6055140 | 0.70 | TSHR (0.41) | CYP3A4CYP2C19ALDH1A1RIPK1TSHR | |
| SCHEMBL6055159 | 0.70 | LMNA (0.47) | CYP3A4CYP2C19ALDH1A1RIPK1TSHR | |
| SCHEMBL8760976 | 0.70 | LMNA (0.47) | CYP3A4CYP2C19ALDH1A1RIPK1TSHR | |
| Hydrogen Peroxide SCHEMBL8837965 | 0.69 | CYP3A4 (0.59) | CYP3A4CYP2C19ALDH1A1TSHRLMNA | |
| SCHEMBL15789305 | 0.67 | ALDH1A1 (0.42) | CYP3A4CYP2C19ALDH1A1RIPK1TSHR | |
| SCHEMBL2208288 | 0.66 | ACP3 (0.41) | CYP3A4CYP2C19TSHRKCNH2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1341745-A1 | RETIFEROL DERIVATIVES AND THEIR USE IN THE TREATMENT OF SKIN DISEASES OR CONDITIONS ASSOCIATED WITH PHOTODAMAGE | F.HOFFMANN-LA ROCHE AG (CH) | 2003-09-10 | — | — | EP | disclosed |
| WO-2002042247-A1 | RETIFEROL DERIVATIVES AND THEIR USE IN THE TREATMENT OF SKIN DISEASES OR CONDITIONS ASSOCIATED WITH PHOTODAMAGE | F.HOFFMANN-LA ROCHE AG (CH) | 2002-05-30 | — | — | WO | disclosed |