Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNA3 | P22001 | 1/20 | 0.70 |
| ▸ | ELANE | P08246 | 7/20 | 0.59 |
| ▸ | TTR | P02766 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | CTSG | P08311 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.44 |
| ▸ | NSD2 | O96028 | 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 | |
|---|---|---|---|---|
| SCHEMBL16076555 | 0.95 | KCNA3 (0.62) | KCNA3ELANETTRCYP1A2CYP2C9 | |
| SCHEMBL27604497 | 0.94 | KCNA3 (0.71) | KCNA3ELANETTRCYP1A2CYP2C9 | |
| SCHEMBL20678449 | 0.94 | KCNA3 (0.71) | KCNA3ELANETTRCYP1A2CYP2C9 | |
| SCHEMBL9017760 | 0.93 | ELANE (0.67) | KCNA3ELANETTRCYP1A2CYP2C9 | |
| SCHEMBL918577 | 0.89 | KCNA3 (0.63) | KCNA3ELANETTRCTSGPTPN1 | |
| SCHEMBL28498709 | 0.88 | KCNA3 (0.62) | KCNA3ELANETTRCYP1A2CYP2C9 | |
| SCHEMBL28050007 | 0.86 | KCNA3 (0.59) | KCNA3ELANETTRCYP1A2CTSG | |
| SCHEMBL16076554 | 0.86 | MAOA (0.56) | KCNA3ELANETTRCTSGSMN1; SMN2 | |
| SCHEMBL6906659 | 0.85 | TTR (0.68) | KCNA3ELANETTRRAB9ASMN1; SMN2 | |
| SCHEMBL28598504 | 0.84 | KCNA3 (0.67) | KCNA3ELANETTRCTSGPTPN1 |
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-109574960-B | Docetaxel derivative and preparation method and application thereof | 南京友怡医药科技有限公司 | 2023-03-21 | — | — | CN | disclosed |