Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.31 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.31 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.31 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.31 |
| ▸ | BCL2 | P10415 | 1/20 | 0.31 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.31 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.30 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.30 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.30 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.30 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.30 |
| ▸ | HDAC10 | Q969S8 | 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 | |
|---|---|---|---|---|
| SCHEMBL5449778 | 0.88 | ALOX5 (0.35) | ALDH1A1CA2CYP3A4LMNATSHR | |
| SCHEMBL9161027 | 0.76 | ALDH1A1 (0.34) | ALDH1A1CA2CYP3A4TSHRMAPK1 | |
| SCHEMBL63069 | 0.73 | TAS1R3 (0.42) | ALDH1A1CA2CYP3A4LMNATSHR | |
| SCHEMBL11524043 | 0.73 | LMNA (0.39) | ALDH1A1CA2CYP3A4LMNATSHR | |
| SCHEMBL3176164 | 0.72 | TDP1 (0.48) | ALDH1A1CA2CYP3A4LMNATSHR | |
| SCHEMBL5751345 | 0.70 | PKM (0.40) | ALDH1A1CA2LMNATSHRMAPK1 | |
| SCHEMBL20548410 | 0.69 | ALDH1A1 (0.48) | ALDH1A1CA2CYP3A4LMNATSHR | |
| SCHEMBL5748233 | 0.69 | ALOX5 (0.34) | ALDH1A1CA2CYP3A4LMNATSHR | |
| SCHEMBL2214479 | 0.68 | — | — | |
| SCHEMBL5525470 | 0.65 | ALDH1A1 (0.39) | ALDH1A1CA2CYP3A4LMNATSHR |
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-1406582-B1 | PHOTOSTABLE ORGANIC SUNSCREEN COMPOUNDS WITH ANTIOXIDANT PROPERTIES AND COMPOSITIONS OBTAINED THEREFROM | MERCK PATENT GMBH (DE) | 2006-10-25 | — | — | EP | claimed |