Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.38 |
| ▸ | CA2 | P00918 | 2/20 | 0.38 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | HTR1D | P28221 | 5/20 | 0.35 |
| ▸ | HTR1A | P08908 | 4/20 | 0.35 |
| ▸ | HTR1B | P28222 | 4/20 | 0.35 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | DRD3 | P35462 | 1/20 | 0.34 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.33 |
| ▸ | TYR | P14679 | 1/20 | 0.33 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.33 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8180028 | 0.90 | TUBB1 (0.42) | ALDH1A1CA1CA2HTR1DHTR1A | |
| SCHEMBL710706 | 0.85 | ALDH1A1 (0.61) | ALDH1A1CA1CA2L3MBTL1MAPT | |
| SCHEMBL29828482 | 0.85 | ALDH1A1 (0.61) | ALDH1A1CA1CA2L3MBTL1MAPT | |
| SCHEMBL15188964 | 0.85 | MAOB (0.41) | ALDH1A1CA1CA2MAOBL3MBTL1 | |
| SCHEMBL2001499 | 0.84 | ALDH1A1 (0.63) | ALDH1A1CA1CA2L3MBTL1MAPT | |
| SCHEMBL4974740 | 0.81 | POLB (0.49) | CA1CA2MAOBPOLBMAPT | |
| SCHEMBL29456101 | 0.81 | POLB (0.49) | CA1CA2MAOBPOLBMAPT | |
| SCHEMBL3200445 | 0.80 | ALDH1A1 (0.56) | ALDH1A1MAOBL3MBTL1TUBB1MAPT | |
| SCHEMBL23043084 | 0.80 | CXCR2 (0.36) | CA1CA2L3MBTL1HTR1DHTR1A | |
| SCHEMBL3905573 | 0.79 | ALDH1A1 (0.69) | ALDH1A1MAOBL3MBTL1TUBB1POLB |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6150413-A | TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS, AS WELL AS MAMMALIAN SKIN AND HAIR CONDITIONS; 4-(4-(BIPHENYL-2-YL)BUT-3-EN-1-YNYL)BENZOIC ACID, FOR EXAMPLE | CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES (FR) | 2000-11-21 | — | — | US | disclosed |