Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 2/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 2/20 | 0.31 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.31 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.31 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL24635574 | 0.85 | ALDH1A1 (0.41) | POLBALDH1A1L3MBTL1TAAR1KCNH2 | |
| SCHEMBL24635664 | 0.84 | DHFR (0.36) | GABRA1GABRB2POLBALDH1A1CLCN2 | |
| SCHEMBL24635669 | 0.81 | KEAP1 (0.41) | POLBALDH1A1PTGS2TAAR1CYP3A4 | |
| SCHEMBL15516016 | 0.79 | KDM4E (0.43) | ALDH1A1L3MBTL1CYP2D6NLRP3GAA | |
| SCHEMBL19993050 | 0.75 | GABRA1 (0.43) | GABRA1GABRB2POLBALDH1A1PTGS2 | |
| SCHEMBL27360925 | 0.74 | MAPT (0.45) | ALDH1A1TAAR1SLC6A2SLC6A4GAA | |
| SCHEMBL29467778 | 0.71 | ALDH1A1 (0.52) | ALDH1A1L3MBTL1CYP3A4ELANEMAPT | |
| SCHEMBL20059276 | 0.69 | TAAR1 (0.46) | GABRA1GABRB2TAAR1KCNH2CYP2D6 | |
| SCHEMBL11169978 | 0.68 | MAPT (0.45) | POLBALDH1A1PTGS2L3MBTL1CYP3A4 | |
| SCHEMBL599099 | 0.67 | GABRA1 (0.57) | GABRA1GABRB2L3MBTL1TAAR1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022226408-A1 | NOVEL ERGOLINES AND METHODS OF TREATING MOOD DISORDERS | GILGAMESH PHARMACEUTICALS, INC. (US) | 2022-10-27 | — | — | WO | disclosed |