Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.57 |
| ▸ | CASP3 | P42574 | 2/20 | 0.47 |
| ▸ | SENP7 | Q9BQF6 | 2/20 | 0.47 |
| ▸ | SENP6 | Q9GZR1 | 2/20 | 0.47 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 8/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 8/20 | 0.44 |
| ▸ | MAPT | P10636 | 6/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | IDE | P14735 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 6/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 6/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | TSHR | P16473 | 3/20 | 0.42 |
| ▸ | HBB | P68871 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9778148 | 1.00 | ALDH1A1 (0.57) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| SCHEMBL3266656 | 0.82 | ALDH1A1 (0.75) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL6703357 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL188378 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL28274947 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL6562161 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL32032 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL11878769 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL565791 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 | |
| Azobenzene SCHEMBL11124477 | 0.76 | ALDH1A1 (1.00) | ALDH1A1CASP3SENP7SENP6SENP8 |
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-5032669-A | Liquid crystalline polyesters formed by reaction of bis(hydroxyalkoxy) biphenyls with terephthaloyl chloride | UNIVERSITY OF MASSACHUSETTS AT AMHERST (US) | 1991-07-16 | — | — | US | disclosed |