Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | PDE8B | O95263 | 4/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | CYP4F2 | P78329 | 4/20 | 0.34 |
| ▸ | CYP4A11 | Q02928 | 4/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | PDE5A | O76074 | 1/20 | 0.32 |
| ▸ | PDE1A | P54750 | 1/20 | 0.32 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.32 |
| ▸ | PDE1C | Q14123 | 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 | |
|---|---|---|---|---|
| SCHEMBL10775607 | 1.00 | ALDH1A1 (0.39) | ALDH1A1GLAGRM2SMN1; SMN2TP53 | |
| SCHEMBL10775612 | 1.00 | ALDH1A1 (0.39) | ALDH1A1GLAGRM2SMN1; SMN2TP53 | |
| SCHEMBL10770777 | 1.00 | ALDH1A1 (0.39) | ALDH1A1GLAGRM2SMN1; SMN2TP53 | |
| SCHEMBL10770782 | 1.00 | ALDH1A1 (0.39) | ALDH1A1GLAGRM2SMN1; SMN2TP53 | |
| SCHEMBL7272765 | 0.80 | RXRA (0.39) | ALDH1A1GLASMN1; SMN2TP53CYP3A4 | |
| SCHEMBL10770956 | 0.76 | CYP4F2 (0.38) | ALDH1A1GRM2TP53PDE8BCYP4F2 | |
| SCHEMBL31178734 | 0.73 | ATR (0.39) | ALDH1A1PDE8BCYP4F2CYP4A11 | |
| SCHEMBL806435 | 0.70 | USP2 (0.49) | ALDH1A1GLACYP3A4TSHRNPC1 | |
| SCHEMBL31586146 | 0.69 | PDE8B (0.40) | ALDH1A1PDE8BCYP4F2CYP4A11 | |
| SCHEMBL21550760 | 0.69 | CYP4F2 (0.39) | ALDH1A1PDE8BCYP4F2CYP4A11 |
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-0231444-A2 | Optically active isomers and racemate of 1-(benztriazol-4-yloxy)-3-[2-(2-methoxyphenoxy)-ethylamino]-2-propanol, process for their preparation as well as their use as medicaments | Roche Diagnostics GmbH (DE) | 1987-08-12 | — | — | EP | claimed |
| EP-0231444-A2 | Optically active isomers and racemate of 1-(benztriazol-4-yloxy)-3-[2-(2-methoxyphenoxy)-ethylamino]-2-propanol, process for their preparation as well as their use as medicaments | Roche Diagnostics GmbH (DE) | 1987-08-12 | — | — | EP | disclosed |