Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | G6PD | P11413 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CCR6 | P51684 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL26447824 | 0.83 | HTT (0.41) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL5377507 | 0.82 | ACHE (0.40) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL4008341 | 0.81 | PGK1 (0.46) | ALDH1A1MAPTGAAKDM4EHPGD | |
| SCHEMBL29007728 | 0.79 | ACHE (0.42) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL28571443 | 0.79 | HTT (0.47) | ALDH1A1MAPTGAAKDM4EHPGD | |
| SCHEMBL9510660 | 0.77 | ACHE (0.40) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL12384205 | 0.76 | MAOB (0.33) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL27709558 | 0.75 | ALDH1A1 (0.36) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL27848436 | 0.75 | ACHE (0.34) | ACHEALDH1A1MAPTGAAKDM4E | |
| SCHEMBL2382572 | 0.73 | HTR1D (0.39) | ALDH1A1HTTPGK1PGK2TSHR |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1024659-C | Phenol derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1994-05-25 | — | — | CN | disclosed |
| EP-0295037-B1 | PHENOL DERIVATIVES, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1993-08-18 | — | — | EP | disclosed |
| US-5162571-A | Phenol derivatives, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-11-10 | — | — | US | disclosed |
| CN-1032001-A | The manufacturing of phenol derivatives and application | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 1989-03-29 | — | — | CN | disclosed |
| EP-0295037-A2 | Phenol derivatives, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1988-12-14 | — | — | EP | disclosed |