Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 4/20 | 0.50 |
| ▸ | TNKS | O95271 | 1/20 | 0.50 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.45 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CCR3 | P51677 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.41 |
| ▸ | PPARD | Q03181 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733617 | 0.89 | ALDH1A1 (0.49) | GAATNKSTNKS2KDM4EALDH1A1 | |
| SCHEMBL13899835 | 0.81 | TNKS (0.63) | GAATNKSTNKS2KDM4EALDH1A1 | |
| SCHEMBL31255953 | 0.81 | TNKS (0.63) | GAATNKSTNKS2KDM4EALDH1A1 | |
| SCHEMBL9734968 | 0.80 | GAA (0.51) | GAAKDM4EALOX5MEN1KMT2A | |
| SCHEMBL17649934 | 0.80 | KDM4E (0.51) | GAATNKSTNKS2KDM4EALDH1A1 | |
| SCHEMBL6554990 | 0.79 | TNKS (0.65) | TNKSTNKS2ALDH1A1CYP3A4ALOX5 | |
| SCHEMBL9733548 | 0.79 | GAA (0.50) | GAAKDM4EMEN1KMT2A | |
| SCHEMBL9734162 | 0.78 | GAA (0.79) | GAAKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL1005864 | 0.77 | TNKS (0.61) | GAATNKSTNKS2KDM4EALDH1A1 | |
| SCHEMBL29274523 | 0.76 | GAA (0.66) | GAAKDM4EALDH1A1TSHRMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5106975-A | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1992-04-21 | — | — | US | disclosed |
| EP-0434185-A2 | Hexahydropyrimidine derivatives | ETHYL PETROLEUM ADDITIVES, INC. (US) | 1991-06-26 | — | — | EP | disclosed |