Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.46 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.46 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.45 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.45 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.44 |
| ▸ | ANO2 | Q9NQ90 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL3416939 | 0.94 | ROCK2 (0.47) | GAAKDM4EROCK2ROCK1HPGD | |
| SCHEMBL3418778 | 0.89 | HSD17B10 (0.52) | GAAROCK2ROCK1HPGDHTT | |
| SCHEMBL3413322 | 0.83 | HSD17B10 (0.50) | GAAKDM4EROCK2ROCK1HPGD | |
| SCHEMBL3413868 | 0.83 | ACLY (0.49) | GAAKDM4EROCK2ROCK1HPGD | |
| SCHEMBL13433426 | 0.83 | PPARD (0.47) | ROCK2ROCK1TMEM97SIGMAR1HPGD | |
| SCHEMBL6495179 | 0.82 | HPGD (0.67) | GAAKDM4EHPGDHTTALDH1A1 | |
| SCHEMBL3416709 | 0.81 | MRGPRX4 (0.48) | GAAKDM4EROCK2ROCK1HPGD | |
| SCHEMBL13433484 | 0.81 | SHMT1 (0.53) | GAATMEM97SIGMAR1HPGDHTT | |
| SCHEMBL3416041 | 0.80 | LMNA (0.50) | GAAKDM4EROCK2ROCK1HPGD | |
| SCHEMBL3418861 | 0.80 | PYGL (0.51) | ROCK2ROCK1HTTLMNAPPARG |
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-7687664-B2 | Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-03-30 | — | — | US | disclosed |
| US-7687664-B2 | Carboxylic acid derivative, a salt thereof or an ester of them, and medicament comprising it | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2010-03-30 | — | — | US | disclosed |