Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTR6 | P50406 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | GFER | P55789 | 1/20 | 0.33 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 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 | |
|---|---|---|---|---|
| SCHEMBL24089350 | 0.77 | ALDH1A1 (0.43) | ALDH1A1CYP3A4MAPTLMNAHPGD | |
| SCHEMBL2095222 | 0.74 | ALDH1A1 (0.46) | ALDH1A1CYP1A1CYP1B1CYP3A4HPGD | |
| SCHEMBL11595072 | 0.74 | ALDH1A1 (0.46) | ALDH1A1CYP1A1CYP1B1CYP3A4HPGD | |
| SCHEMBL7300875 | 0.73 | TAAR1 (0.45) | ALDH1A1CYP1A1CYP1B1CYP3A4CA12 | |
| SCHEMBL10704960 | 0.72 | ERN1 (0.41) | ALDH1A1HSP90AA1CYP3A4MAPTHPGD | |
| SCHEMBL15226652 | 0.72 | ACACB (0.43) | HSP90AA1HSP90AB1MAPTRAB9ACA12 | |
| SCHEMBL94929 | 0.72 | ALDH1A1 (0.45) | ALDH1A1CYP3A4MAPTLMNAHPGD | |
| SCHEMBL1047515 | 0.72 | ALDH1A1 (0.56) | ALDH1A1CYP1A1CYP1B1CYP3A4HPGD | |
| SCHEMBL2560197 | 0.70 | ALDH1A1 (0.53) | ALDH1A1CYP1A1CYP1B1CYP3A4MAPT | |
| SCHEMBL8430640 | 0.70 | ALDH1A1 (0.53) | ALDH1A1CYP1A1CYP1B1CYP3A4HPGD |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5773456-A | EMPHYSEMA, RHEUMATOID ARTHRITIS AND PANCREATITIS | SANOFI (FR) | 1998-06-30 | — | — | US | disclosed |
| US-5578623-A | DRUGS FOR TREATMENT OF ARTHRITIS, PANCREATITIS, CYSTIC FIBROSIS, BRONCHITIS, RESPIRATORY DISORDERS | STERLING WINTHROP INC. (US) | 1996-11-26 | — | — | US | disclosed |
| US-5464852-A | Used in treatment of degenerative diseases | STERLING WINTHROP INC. (US) | 1995-11-07 | — | — | US | disclosed |
| US-5380737-A | Enzyme inhibitors | STERLING WINTHROP INC. (US) | 1995-01-10 | — | — | US | disclosed |
| EP-0542371-A1 | Saccharin derivative proteolytic enzyme inhibitors | STERLING WINTHROP INC. (US) | 1993-05-19 | — | — | EP | disclosed |