Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.49 |
| ▸ | SLC15A1 | P46059 | 2/20 | 0.48 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.45 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.45 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.41 |
| ▸ | ATM | Q13315 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL15514249 | 0.88 | SLC15A1 (0.57) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL29387237 | 0.88 | SLC15A1 (0.57) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL29819498 | 0.86 | ALDH1A1 (0.50) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL29772314 | 0.84 | ALDH1A1 (0.55) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL8882746 | 0.84 | ALDH1A1 (0.47) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL306311 | 0.80 | ALDH1A1 (0.58) | ALDH1A1SLC15A1KMT2AMAPK1L3MBTL1 | |
| SCHEMBL29730806 | 0.79 | ANPEP (0.49) | ALDH1A1SLC15A1SLC1A1LTA4HCTSL | |
| SCHEMBL29624272 | 0.78 | ALDH1A1 (0.51) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL9744412 | 0.78 | KMT2A (0.50) | ALDH1A1SLC15A1SLC1A3SLC1A2SLC1A1 | |
| SCHEMBL7635472 | 0.76 | ALDH1A1 (0.53) | ALDH1A1KMT2AMAPK1L3MBTL1SLC6A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5807870-A | SIDE EFFECT REDUCTION | BIOMEGA BOEHRINGER INGELHEIM RESEARCH LTD. (CA) | 1998-09-15 | — | — | US | disclosed |
| US-5614533-A | Substituted pipecolinic acid derivatives as HIV protease inhibitors | BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH, INC. (CA) | 1997-03-25 | — | — | US | disclosed |