Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 11/20 | 0.59 |
| ▸ | LTA4H | P09960 | 2/20 | 0.50 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | NPC1 | O15118 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | THRA | P10827 | 1/20 | 0.46 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | WDR5 | P61964 | 2/20 | 0.45 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.43 |
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11071449 | 0.95 | ESR1 (0.58) | ESR1LTA4HNR5A1THRATHRB | |
| SCHEMBL9699080 | 0.93 | ESR1 (0.61) | ESR1LTA4HNR5A1MEN1MAPT | |
| SCHEMBL11796987 | 0.93 | ESR1 (0.61) | ESR1LTA4HNR5A1MEN1MAPT | |
| SCHEMBL9697402 | 0.93 | ESR1 (0.61) | ESR1LTA4HNR5A1MEN1MAPT | |
| SCHEMBL9699688 | 0.93 | ESR1 (0.61) | ESR1LTA4HNR5A1MEN1MAPT | |
| SCHEMBL14747883 | 0.91 | ESR1 (0.49) | ESR1LTA4HMEN1ALDH1A1GAA | |
| SCHEMBL3291614 | 0.86 | ESR1 (0.54) | ESR1LTA4HNR5A1THRATHRB | |
| SCHEMBL3995606 | 0.85 | LTA4H (0.50) | ESR1LTA4HNR5A1MEN1NPC1 | |
| SCHEMBL3006259 | 0.83 | ALDH1A1 (0.60) | ESR1LTA4HNR5A1MEN1NPC1 | |
| SCHEMBL19433121 | 0.83 | LTA4H (0.52) | ESR1LTA4HNR5A1MEN1NPC1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0887346-B1 | N-Phenyl-alkylsulfonamide derivatives, their preparation and their use as alpha1A/1L adrenoceptor agonists | HOFFMANN LA ROCHE (CH) | 2007-12-12 | — | — | EP | disclosed |
| CN-1059895-C | Method for preparing alkoxy substituted triphenylamine | MITSUI TOATSU CHEMICALS (JP) | 2000-12-27 | — | — | CN | disclosed |
| US-5654483-A | REACTING ALKOXY-SUBSTITUTED CYCLOHEXANONE WITH DIPHENYLAMINE WHILE FORMING CYCLOHEXANONE FROM ALKOXY-SUBSTITUTED PHENOL IN PRESENCE OF SURFACE-SUPPORTED HYDROGEN TRANSFER CATALYST | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-08-05 | — | — | US | disclosed |
| CN-1130174-A | Method for preparing alkoxy substituted triphenylamine | MITSUI TOATSU CHEMICALS (JP) | 1996-09-04 | — | — | CN | disclosed |