Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | PKM | P14618 | 2/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 5/20 | 0.44 |
| ▸ | RAB9A | P51151 | 5/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28238300 | 0.87 | ATM (0.44) | KMT2AGAAMAPTPKMRXFP1 | |
| SCHEMBL28280836 | 0.86 | MEN1 (0.59) | KMT2AMAPTPKMRXFP1NPC1 | |
| SCHEMBL28239168 | 0.85 | MAPT (0.45) | KMT2AMAPTPKMRXFP1THRB | |
| SCHEMBL28238198 | 0.84 | ALDH1A1 (0.61) | KMT2AGAAMAPTPKMNPC1 | |
| SCHEMBL28280837 | 0.84 | PKM (0.60) | KMT2AMAPTPKMRXFP1THRB | |
| SCHEMBL28238250 | 0.83 | PKM (0.44) | KMT2AMAPTPKMRXFP1NPC1 | |
| SCHEMBL28238294 | 0.83 | RAB9A (0.47) | KMT2AGAAMAPTPKMRXFP1 | |
| SCHEMBL28282155 | 0.82 | KDM4E (0.46) | KMT2AGAAMAPTPKMRXFP1 | |
| SCHEMBL28239238 | 0.81 | CYP1A2 (0.63) | KMT2AGAAMAPTPKMNPC1 | |
| SCHEMBL28238186 | 0.75 | NPC1 (0.47) | KMT2AMAPTPKMNPC1RAB9A |
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-109438427-A | A kind of triazole schiff bases myricetin derivative, the preparation method and the usage of Sulfide-containing Hindered | 贵州大学 | 2019-03-08 | — | — | CN | disclosed |
| CN-108358896-A | A kind of compound and preparation method being used to prepare prevention crop pathogenic bacteria drug | 贵州大学 | 2018-08-03 | — | — | CN | disclosed |