Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CCR5 | P51681 | 5/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 2/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8107586 | 1.00 | ALDH1A1 (0.38) | ALDH1A1CCR5MAPTHPGDPOLB | |
| SCHEMBL8098780 | 1.00 | ALDH1A1 (0.38) | ALDH1A1CCR5MAPTHPGDPOLB | |
| SCHEMBL8957551 | 0.92 | ALDH1A1 (0.38) | ALDH1A1CCR5MAPTHPGDTDP1 | |
| SCHEMBL8107959 | 0.92 | ALDH1A1 (0.38) | ALDH1A1CCR5MAPTHPGDTDP1 | |
| SCHEMBL8107960 | 0.92 | ALDH1A1 (0.38) | ALDH1A1CCR5MAPTHPGDTDP1 | |
| SCHEMBL8108005 | 0.87 | CCR5 (0.36) | ALDH1A1CCR5MAPTHPGDPOLB | |
| SCHEMBL8098389 | 0.87 | CCR5 (0.36) | ALDH1A1CCR5MAPTHPGDPOLB | |
| SCHEMBL8098392 | 0.87 | CCR5 (0.36) | ALDH1A1CCR5MAPTHPGDPOLB | |
| SCHEMBL8098307 | 0.86 | CCR5 (0.37) | ALDH1A1CCR5MAPTHPGDTDP1 | |
| SCHEMBL8112376 | 0.85 | CCR5 (0.36) | ALDH1A1CCR5MAPTHPGDHTR2A |
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-0545290-B1 | Aminoalkylpyrrolidinylthiocarbapenem derivatives | BANYU PHARMA CO LTD (JP) | 2000-08-23 | — | — | EP | disclosed |
| US-5550121-A | ANTIBIOTICS | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1996-08-27 | — | — | US | disclosed |
| EP-0545290-A1 | Aminoalkylpyrrolidinylthiocarbapenem derivatives | BANYU PHARMACEUTICAL CO., LTD. (JP) | 1993-06-09 | — | — | EP | disclosed |