Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRB | P10828 | 1/20 | 0.71 |
| ▸ | ATM | Q13315 | 1/20 | 0.71 |
| ▸ | BCHE | P06276 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.67 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.67 |
| ▸ | RELA | Q04206 | 1/20 | 0.67 |
| ▸ | GSK3B | P49841 | 1/20 | 0.60 |
| ▸ | MEN1 | O00255 | 4/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.58 |
| ▸ | MAOB | P27338 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 2/20 | 0.58 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.58 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.58 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.58 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.58 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.57 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.57 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Benzophenone SCHEMBL28282178 | 0.87 | THRB (0.78) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL28105146 | 0.86 | THRB (0.89) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL58700 | 0.84 | THRB (1.00) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL12473722 | 0.84 | THRB (1.00) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL58699 | 0.84 | THRB (1.00) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL5330596 | 0.83 | THRB (0.96) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL10935651 | 0.83 | THRB (0.96) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL2298853 | 0.83 | THRB (0.96) | THRBATMBCHECYP3A4NFKB1 | |
| 4-Methoxycinnamic Acid SCHEMBL8500105 | 0.83 | THRB (0.96) | THRBATMBCHECYP3A4NFKB1 | |
| SCHEMBL747850 | 0.83 | NPC1 (0.71) | CYP3A4GSK3BMEN1KMT2AALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108025196-A | Water-In-Oil light screening composition with organic sunscreen actives | 莱雅公司 | 2018-05-11 | — | — | CN | claimed |