Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 8/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | RAF1 | P04049 | 1/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | GFER | P55789 | 1/20 | 0.52 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.52 |
| ▸ | GAA | P10253 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | PKM | P14618 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 1/20 | 0.48 |
| ▸ | CRHBP | P24387 | 1/20 | 0.48 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.48 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL22121183 | 0.86 | MAPT (0.54) | HTTMAPTALDH1A1HPGDMAPK1 | |
| SCHEMBL8033266 | 0.86 | MAPT (0.67) | HTTMAPTALDH1A1LMNAMAPK1 | |
| SCHEMBL28552286 | 0.84 | MAPT (0.55) | HTTMAPTALDH1A1LMNAHPGD | |
| SCHEMBL12004226 | 0.83 | MAPT (0.56) | MAPTALDH1A1LMNAPKMRAB9A | |
| SCHEMBL28545286 | 0.82 | ALDH1A1 (0.52) | HTTMAPTALDH1A1LMNAHPGD | |
| SCHEMBL4542148 | 0.81 | LMNA (0.53) | HTTMAPTALDH1A1LMNAL3MBTL1 | |
| SCHEMBL29343397 | 0.81 | KMT2A (0.50) | MAPTALDH1A1LMNAHPGDGAA | |
| SCHEMBL31072780 | 0.81 | KMT2A (0.50) | MAPTALDH1A1LMNAHPGDGAA | |
| SCHEMBL31072813 | 0.81 | MAPT (0.59) | MAPTALDH1A1HPGDPKMRAB9A | |
| SCHEMBL29342739 | 0.81 | MAPT (0.59) | MAPTALDH1A1HPGDPKMRAB9A |
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-107434789-B | Benzotriazole derivatives, preparation method thereof, pharmaceutical composition and application thereof | 中国医学科学院药物研究所 | 2021-04-13 | — | — | CN | disclosed |