Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IMPDH2 | P12268 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.37 |
| ▸ | AOC1 | P19801 | 2/20 | 0.36 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13345451 | 0.86 | IMPDH2 (0.41) | IMPDH2GAAPOLBTGFBR1TGFBR2 | |
| SCHEMBL3823546 | 0.83 | POLB (0.43) | GAAPOLBTGFBR1TGFBR2TSHR | |
| SCHEMBL4956799 | 0.79 | ADRA2A (0.40) | GAAPOLBTGFBR1TGFBR2TSHR | |
| SCHEMBL2790469 | 0.76 | GAA (0.42) | IMPDH2GAAAOC1AOC3CYP3A4 | |
| SCHEMBL11628534 | 0.76 | ALDH1A1 (0.53) | GAAPOLBAOC1AOC3HPGD | |
| SCHEMBL8811300 | 0.75 | POLB (0.38) | GAAPOLBTGFBR1TGFBR2TSHR | |
| SCHEMBL15288914 | 0.73 | GAA (0.52) | GAATSHRMAPT | |
| SCHEMBL4958013 | 0.73 | POLB (0.40) | GAAPOLBTGFBR1TGFBR2HPGD | |
| SCHEMBL4608367 | 0.73 | ALDH1A1 (0.55) | TSHRHPGDMAPK1HSD17B10CYP3A4 | |
| SCHEMBL27624925 | 0.73 | ALDH1A1 (0.47) | GAAPOLBAOC1AOC3HPGD |
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-108191781-B | Substituted triazole derivative and application thereof in preparation of anti-tumor metastasis drugs | 浙江大学 | 2020-01-21 | — | — | CN | disclosed |
| CN-108191781-A | Substituted 1,2,4-triazole analog derivative and its application in medicine for anti transfer of tumor is prepared | 浙江大学 | 2018-06-22 | — | — | CN | disclosed |