Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | F10 | P00742 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.31 |
| ▸ | GFER | P55789 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 2/20 | 0.31 |
| ▸ | RAB9A | P51151 | 2/20 | 0.31 |
| ▸ | ATM | Q13315 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9587860 | 0.78 | CA1 (0.38) | PDK2ALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL9589108 | 0.78 | LMNA (0.34) | PDK2MAPTHPGDF10TSHR | |
| SCHEMBL9588058 | 0.76 | CA1 (0.43) | MAPTKDM4ECYP1A2CYP2D6CYP2C9 | |
| SCHEMBL9587447 | 0.76 | TSHR (0.40) | GAAPDK2ALDH1A1HPGDCYP1A2 | |
| SCHEMBL9587585 | 0.75 | PDK2 (0.39) | PDK2ALOX5 | |
| SCHEMBL9588069 | 0.73 | CA1 (0.38) | PDK2ALDH1A1HPGDCYP1A2CYP3A4 | |
| SCHEMBL9704036 | 0.68 | ABCC9 (0.40) | PDK2CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9598283 | 0.68 | ABCC9 (0.40) | PDK2CYP1A2CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL9589382 | 0.65 | PDK2 (0.41) | PDK2ALDH1A1MAPTKMT2AALOX5 | |
| SCHEMBL5221418 | 0.65 | ALDH1A1 (0.53) | GAAALDH1A1MAPTKDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-5272170-A | Tetralones with pharmacological activity | J. URIACH & CIA., S.A. (ES) | 1993-12-21 | — | — | US | disclosed |
| US-5208246-A | Hypotensive, bronchodilator | J. URIACH & CIA. (ES) | 1993-05-04 | — | — | US | disclosed |
| EP-0489300-A2 | Tetralones with pharmacological activity | J. URIACH & CIA. S.A. (ES) | 1992-06-10 | — | — | EP | disclosed |