Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | JAK2 | O60674 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9262605 | 0.96 | ALDH1A1 (0.51) | ALDH1A1MAPTTRPM8ADRB2GAA | |
| SCHEMBL9255807 | 0.82 | MAPT (0.41) | ALDH1A1MAPTTRPM8ADRB2GAA | |
| SCHEMBL9263157 | 0.82 | ALDH1A1 (0.44) | ALDH1A1MAPTTRPM8ADRB2GAA | |
| SCHEMBL9261032 | 0.79 | MAPT (0.48) | ALDH1A1MAPTTRPM8ADRB2GAA | |
| SCHEMBL9262112 | 0.74 | MAPT (0.43) | ALDH1A1MAPTGAALMNASMN1; SMN2 | |
| SCHEMBL9258362 | 0.73 | HPGD (0.43) | ALDH1A1MAPTGAALMNASMN1; SMN2 | |
| SCHEMBL8959907 | 0.73 | ALDH1A1 (0.64) | ALDH1A1MAPTADRB2GAALMNA | |
| SCHEMBL9263496 | 0.70 | NR1H2 (0.39) | ALDH1A1MAPTTRPM8GAALMNA | |
| SCHEMBL9260062 | 0.70 | CA12 (0.37) | ALDH1A1MEN1KMT2ACYP3A4CYP2C9 | |
| SCHEMBL9001628 | 0.69 | ADRA2C (0.71) | ALDH1A1MAPTADRB2GAALMNA |
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-5439909-A | 2-Substituted with amide or thioamide group; antioxidant for lipoproteins, antilipemic agents, anticholesterol agents | ADIR ET COMPAGNIE (FR) | 1995-08-08 | — | — | US | disclosed |
| EP-0624582-A1 | Substituted benzodioxine, process for their preparation and pharmaceutical compositions containing them | ADIR ET COMPAGNIE (FR) | 1994-11-17 | — | — | EP | disclosed |