Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 3/20 | 0.36 |
| ▸ | PPARD | Q03181 | 3/20 | 0.36 |
| ▸ | PPARA | Q07869 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP1 | P29466 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CASP7 | P55210 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL26923113 | 0.89 | DRD2 (0.40) | MAPTALDH1A1GFERTYMS | |
| SCHEMBL8559068 | 0.86 | MAPT (0.50) | HRH3MAPTKDM4ECA12CA1 | |
| SCHEMBL30480861 | 0.84 | PNMT (0.47) | HRH3MAPTKDM4ECA12CA1 | |
| SCHEMBL17785608 | 0.84 | PNMT (0.47) | HRH3MAPTKDM4ECA12CA1 | |
| SCHEMBL23157401 | 0.74 | DRD2 (0.53) | HRH3MAPTKDM4ECA12CA1 | |
| SCHEMBL8669783 | 0.72 | TSHR (0.40) | MAPTCA12CA1CA2ALDH1A1 | |
| SCHEMBL9432052 | 0.72 | ALDH1A1 (0.41) | CA12CA1CA2ALDH1A1TYMS | |
| SCHEMBL748146 | 0.72 | PNMT (0.55) | GFER | |
| SCHEMBL15320816 | 0.72 | MAPT (0.46) | HRH3MAPTKDM4ECA12CA1 | |
| SCHEMBL596333 | 0.72 | PNMT (0.48) | HRH3MAPTKDM4ECA12CA1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118259012-A | Method for global analysis of functional histidines in proteins | 深圳湾实验室 | 2024-06-28 | — | — | CN | disclosed |
| CN-104945389-A | Xanthone cross-color ketone compound as well as preparation method and application thereof | SHANGHAI INST MATERIA MEDICA | 2015-09-30 | — | — | CN | disclosed |
| EP-0825986-A1 | QUINOLYL-ETHYNYL DERIVATIVES HAVING RETINOID-LIKE ACTIVITY | Allergan (US) | 1998-03-04 | — | — | EP | disclosed |
| US-5616712-A | SKIN DISORDERS; ANTICARCINOGENIC AND -INFLAMMATORY AGENTS; AUTOIMMUNE DISEASES; | ALLERGAN (US) | 1997-04-01 | — | — | US | disclosed |
| WO-1996036609-A1 | QUINOLYL-ETHYNYL DERIVATIVES HAVING RETINOID-LIKE ACTIVITY | ALLERGAN (US) | 1996-11-21 | — | — | WO | disclosed |