Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.53 |
| ▸ | GAA | P10253 | 4/20 | 0.53 |
| ▸ | LMNA | P02545 | 3/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 4/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.37 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.37 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.37 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8035378 | 0.80 | ALDH1A1 (0.59) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL29031406 | 0.79 | ALDH1A1 (0.57) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL29031363 | 0.78 | ALDH1A1 (0.53) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL29031409 | 0.75 | ALDH1A1 (0.54) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL29031400 | 0.74 | ALDH1A1 (0.49) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL10419854 | 0.74 | ALDH1A1 (0.46) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL8145600 | 0.73 | MEN1 (0.48) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL19346861 | 0.73 | ALDH1A1 (0.44) | ALDH1A1GAALMNASMN1; SMN2TDP1 | |
| SCHEMBL13482210 | 0.73 | ALDH1A1 (0.43) | ALDH1A1GAALMNAL3MBTL1GABRA1 | |
| SCHEMBL9447402 | 0.72 | ALDH1A1 (0.54) | ALDH1A1GAALMNASMN1; SMN2TDP1 |
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-2018011375-A1 | MECLOZINE DERIVATIVES AND DICLAZURIL DERIVATIVES FOR USE IN THE PREVENTION AND/OR THE TREATMENT OF DISORDERS ASSOCIATED TO THE INFLAMMATION INDUCED BY P. ACNES | UNIVERSITE PARIS DESCARTES (FR) | 2018-01-18 | — | — | WO | disclosed |