Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 12/20 | 0.49 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.49 |
| ▸ | PKM | P14618 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | RECQL | P46063 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | APEX1 | P27695 | 1/20 | 0.33 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL11216015 | 0.89 | ALDH1A1 (0.53) | ALDH1A1L3MBTL1PKMTSHRGAA | |
| SCHEMBL10887977 | 0.78 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1PKMTSHRGAA | |
| SCHEMBL10887982 | 0.78 | ALDH1A1 (0.50) | ALDH1A1L3MBTL1PKMTSHRGAA | |
| SCHEMBL9493724 | 0.77 | ALDH1A1 (0.31) | ALDH1A1L3MBTL1RECQLMCL1 | |
| SCHEMBL10880745 | 0.74 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1PKMTSHRGAA | |
| SCHEMBL10880739 | 0.74 | ALDH1A1 (0.49) | ALDH1A1L3MBTL1PKMTSHRGAA | |
| SCHEMBL9492049 | 0.73 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1PKMGAAPOLB | |
| SCHEMBL11097940 | 0.72 | ALDH1A1 (0.41) | ALDH1A1L3MBTL1PKMPOLBMEN1 | |
| SCHEMBL10899048 | 0.69 | ALDH1A1 (0.40) | ALDH1A1L3MBTL1PKMGAAMAPT | |
| SCHEMBL10876986 | 0.68 | ALDH1A1 (0.33) | ALDH1A1L3MBTL1RECQLMCL1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0085275-B1 | SUBSTITUTED THIAZOLIDINYLIC ESTERS OF MINERAL ACIDS | CIBA-GEIGY AG (CH) | 1986-02-19 | — | — | EP | claimed |
| US-4489069-A | ANTITUMOR | CIBA-GEIGY AG (CH) | 1984-12-18 | — | — | US | claimed |
| US-4582841-A | ANTITUMOR AND -CARCINOGENIC AGENTS | CIBA-GEIGY CORPORATION (US) | 1986-04-15 | — | — | US | disclosed |
| US-4489069-A | ANTITUMOR | CIBA-GEIGY AG (CH) | 1984-12-18 | — | — | US | disclosed |