Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.39 |
| ▸ | THRB | P10828 | 2/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | KCNH3 | Q9ULD8 | 6/20 | 0.35 |
| ▸ | NPR3 | P17342 | 3/20 | 0.34 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.34 |
| ▸ | CDK2 | P24941 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12620564 | 0.83 | KCNH3 (0.48) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL7167324 | 0.81 | NFKB1 (0.38) | ALDH1A1L3MBTL1TDP1TP53SMN1; SMN2 | |
| SCHEMBL28563944 | 0.80 | TDP1 (0.52) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL39071 | 0.79 | ALDH1A1 (0.58) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL28569242 | 0.78 | TDP1 (0.42) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL28544980 | 0.77 | CA1 (0.45) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL14817562 | 0.76 | ALDH1A1 (0.44) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL10382992 | 0.75 | RAB9A (0.44) | ALDH1A1ALOX15TSHRHSD17B10ALOX12 | |
| SCHEMBL201628 | 0.75 | ALDH1A1 (0.71) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 | |
| SCHEMBL11473377 | 0.74 | ALDH1A1 (0.43) | ALDH1A1CYP3A4ALOX15TSHRHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112759557-B | Compound with anti-aging and discoloration-resistant effects and preparation method thereof | 圣奥化学科技有限公司 | 2023-12-29 | — | — | CN | disclosed |
| CN-112759557-A | Compound with anti-aging and anti-discoloration effects and preparation method thereof | 圣奥化学科技有限公司 | 2021-05-07 | — | — | CN | disclosed |