Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 15/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL8106386 | 0.93 | CCR5 (0.35) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL8098059 | 0.93 | CCR5 (0.35) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL8107064 | 0.93 | CCR5 (0.35) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL8112376 | 0.88 | CCR5 (0.36) | CCR5HTR2AALDH1A1MAPTHPGD | |
| SCHEMBL8112453 | 0.87 | CCR5 (0.38) | CCR5 | |
| SCHEMBL8098389 | 0.86 | CCR5 (0.36) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL8108005 | 0.86 | CCR5 (0.36) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL8098392 | 0.86 | CCR5 (0.36) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL10520181 | 0.82 | ALDH1A1 (0.36) | CCR5HTR2AALDH1A1ATMMAPT | |
| SCHEMBL8107959 | 0.81 | ALDH1A1 (0.38) | CCR5HTR2AALDH1A1ATMMAPT |
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 |