Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29399630 | 0.91 | ESR1 (0.50) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL29412586 | 0.91 | ESR1 (0.50) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL766058 | 0.91 | ESR1 (0.50) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL29397448 | 0.87 | ESR1 (0.56) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL29412591 | 0.87 | ESR1 (0.56) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL565076 | 0.87 | ESR1 (0.56) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL4295432 | 0.84 | ALDH1A1 (0.52) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL564039 | 0.80 | ESR1 (0.61) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL564979 | 0.80 | ESR1 (0.48) | ESR1ESR2ALDH1A1MEN1GAA | |
| SCHEMBL8515161 | 0.80 | ALDH1A1 (0.66) | ESR1ESR2ALDH1A1MEN1GAA |
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-5081229-A | Copolyerizing 4,4*-diaminodiphenyl ether, P-phenylenediamine and aromatic tetracarboxylic dianhydride | KANEGAFUCHI CHEMICAL IND. CO., LTD. (JP) | 1992-01-14 | — | — | US | disclosed |