Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | SMYD2 | Q9NRG4 | 3/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KCNH3 | Q9ULD8 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | PPARG | P37231 | 1/20 | 0.32 |
| ▸ | PPARD | Q03181 | 1/20 | 0.32 |
| ▸ | PPARA | Q07869 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5026143 | 1.00 | ALDH1A1 (0.41) | ALDH1A1CYP3A4HPGDALOX15USP2 | |
| SCHEMBL5030044 | 0.99 | ALDH1A1 (0.39) | ALDH1A1CYP3A4HPGDALOX15USP2 | |
| SCHEMBL5028036 | 0.95 | SMYD2 (0.38) | ALDH1A1CYP3A4HPGDALOX15USP2 | |
| SCHEMBL5027934 | 0.89 | SMYD2 (0.39) | ALDH1A1CYP3A4HPGDALOX15USP2 | |
| SCHEMBL21413118 | 0.82 | ALDH1A1 (0.50) | ALDH1A1CYP3A4HPGDALOX15USP2 | |
| SCHEMBL5030567 | 0.81 | ALDH1A1 (0.40) | ALDH1A1HPGDALOX15USP2TDP1 | |
| SCHEMBL29111194 | 0.80 | ALDH1A1 (0.41) | ALDH1A1TDP1SMYD2MAPK1KCNH3 | |
| SCHEMBL29142571 | 0.79 | SMYD2 (0.37) | CYP3A4SMYD2HTTSMN1; SMN2 | |
| SCHEMBL18189103 | 0.78 | EPHX2 (0.40) | CYP3A4SMYD2HTTMAPTSMN1; SMN2 | |
| SCHEMBL13284463 | 0.77 | SOAT1 (0.41) | ALDH1A1CYP3A4SMYD2MAPK1HTT |
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 |
|---|---|---|---|---|---|---|---|
| EP-1939191-A1 | Furan derivatives, method of synthesis and uses thereof | Neuropharma S.A. (ES) | 2008-07-02 | — | — | EP | claimed |
| EP-1939191-A1 | Furan derivatives, method of synthesis and uses thereof | Neuropharma S.A. (ES) | 2008-07-02 | — | — | EP | disclosed |