Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | MAOB | P27338 | 1/20 | 0.47 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.45 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.45 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.45 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | GFER | P55789 | 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 | |
|---|---|---|---|---|
| SCHEMBL9580861 | 0.85 | ESR1 (0.62) | ESR1ALDH1A1MAOAMAOBNR1H3 | |
| SCHEMBL11669569 | 0.79 | ESR1 (0.55) | ESR1ALDH1A1MAOAMAOBNR1H3 | |
| SCHEMBL25899286 | 0.78 | ESR1 (0.62) | ESR1ALDH1A1NR1H3ESR2CA12 | |
| SCHEMBL10560584 | 0.76 | ALDH1A1 (0.49) | ALDH1A1MAOAMAOBNPC1CASP3 | |
| SCHEMBL18589041 | 0.75 | ESR1 (0.68) | ESR1ALDH1A1NR1H3NPC1RAB9A | |
| SCHEMBL19773976 | 0.74 | KMT2A (0.68) | ESR1ALDH1A1NR1H3CASP3SMN1; SMN2 | |
| N-Phenyl-Phthalimide SCHEMBL123618 | 0.74 | KMT2A (0.68) | ESR1ALDH1A1NR1H3CASP3SMN1; SMN2 | |
| N-Phenyl-Phthalimide SCHEMBL29819622 | 0.74 | KMT2A (0.68) | ESR1ALDH1A1NR1H3CASP3SMN1; SMN2 | |
| SCHEMBL11871494 | 0.74 | HSPA1A (0.52) | ESR1ALDH1A1NR1H3SMN1; SMN2MEN1 | |
| SCHEMBL9473886 | 0.73 | ESR1 (0.64) | ESR1ALDH1A1NR1H3NPC1RAB9A |
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-4808696-A | FROM DIANHYDRIDE AND/OR DIIMIDES AND ALKALI METAL SULFIDE | GENERAL ELECTRIC COMPANY (US) | 1989-02-28 | — | — | US | disclosed |
| EP-0293693-A2 | Method for making organobis(Thioether)s, and products obtained therefrom | GENERAL ELECTRIC COMPANY (US) | 1988-12-07 | — | — | EP | disclosed |