Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | MEN1 | O00255 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | CES2 | O00748 | 1/20 | 0.47 |
| ▸ | MGLL | Q99685 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | CETP | P11597 | 1/20 | 0.44 |
| ▸ | IDO1 | P14902 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | XBP1 | P17861 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL29635769 | 0.98 | ALDH1A1 (0.58) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL592796 | 0.98 | ALDH1A1 (0.58) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL10607069 | 0.95 | ALDH1A1 (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| Water SCHEMBL28200366 | 0.95 | ALDH1A1 (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| Ammonia Solution, Strong SCHEMBL28249187 | 0.95 | ALDH1A1 (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL1504949 | 0.95 | ALDH1A1 (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL28270887 | 0.95 | ALDH1A1 (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL1504946 | 0.95 | ALDH1A1 (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL3199396 | 0.89 | MAPT (0.56) | ALDH1A1MEN1MAPTKMT2ACYP1A2 | |
| SCHEMBL2033058 | 0.87 | MEN1 (0.50) | ALDH1A1MEN1MAPTKMT2ACYP1A2 |
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-109608369-A | Sulphonyl ester group anthraquinone derivatives and its preparation method and application | 广西大学 | 2019-04-12 | — | — | CN | disclosed |