Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | HTR1A | P08908 | 5/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 5/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 5/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 5/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9584569 | 0.83 | ALDH1A1 (0.44) | ALDH1A1GLAADRA2CMAPTHTR1A | |
| SCHEMBL9585096 | 0.83 | ALDH1A1 (0.51) | ALDH1A1GLAADRA2CHTR1AADRA1D | |
| SCHEMBL9711733 | 0.81 | POLB (0.51) | ALDH1A1GLAADRA2CHTR1AADRA1D | |
| SCHEMBL9585387 | 0.81 | ALDH1A1 (0.51) | ALDH1A1GLAADRA2CHTR1AADRA1D | |
| SCHEMBL9584274 | 0.81 | ALDH1A1 (0.51) | ALDH1A1GLAADRA2CHTR1AADRA1D | |
| SCHEMBL9585261 | 0.81 | ALDH1A1 (0.51) | ALDH1A1GLAADRA2CHTR1AADRA1D | |
| SCHEMBL9585535 | 0.81 | ALDH1A1 (0.44) | ALDH1A1GLAADRA2CMAPTHTR1A | |
| SCHEMBL9711754 | 0.79 | POLB (0.43) | ALDH1A1GLAADRA2CMAPTHTR1A | |
| SCHEMBL9584987 | 0.78 | ALDH1A1 (0.51) | ALDH1A1GLAADRA2CHTR1AADRA1D | |
| SCHEMBL9585783 | 0.78 | PKM (0.53) | ALDH1A1MAPTLMNACYP1A2MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0303227-B1 | ETHERS AND THIOETHERS HAVING THERAPEUTICAL ACTIVITY, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1992-02-05 | — | — | EP | disclosed |
| US-4968706-A | MUCOLYTIC, ANTITUSSIVE, BRONCHODILATOR, ANTIINFLAMMATORY | BOEHRINGER MANNHEIN ITALIA, S.P.A. (IT) | 1990-11-06 | — | — | US | disclosed |
| EP-0303227-A1 | Ethers and thioethers having therapeutical activity, their preparation and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1989-02-15 | — | — | EP | disclosed |