Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | GRK6 | P43250 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | SELP | P16109 | 1/20 | 0.33 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 2/20 | 0.32 |
| ▸ | CA2 | P00918 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | PARP15 | Q460N3 | 1/20 | 0.32 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9712081 | 0.92 | PTPN1 (0.36) | PTPN1GRK6ALDH1A1GAAPKM | |
| SCHEMBL9585086 | 0.85 | ACHE (0.39) | PTPN1ACHEALDH1A1GAAPKM | |
| SCHEMBL9711718 | 0.84 | PKM (0.49) | ALDH1A1GAAPKMHPGDMAPT | |
| SCHEMBL9712008 | 0.83 | PTPN1 (0.36) | PTPN1ACHEALDH1A1SELPPKM | |
| SCHEMBL9711750 | 0.83 | POLB (0.43) | ALDH1A1GAAHPGDMAPTTDP1 | |
| SCHEMBL10516427 | 0.81 | ACHE (0.36) | PTPN1ACHEALDH1A1GAAPKM | |
| SCHEMBL9585869 | 0.81 | ACHE (0.41) | PTPN1ACHEALDH1A1PKMHPGD | |
| SCHEMBL9711941 | 0.80 | ALDH1A1 (0.34) | GRK6ALDH1A1GAAMAPTKMT2A | |
| SCHEMBL9585454 | 0.78 | ACHE (0.41) | PTPN1ACHEALDH1A1PKMHPGD | |
| SCHEMBL9711788 | 0.77 | PPARA (0.49) | ALDH1A1GAAMAPTKMT2ACYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0303227-B1 | ETHERS AND THIOETHERS HAVING THERAPEUTICAL ACTIVITY, THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1992-02-05 | — | — | EP | disclosed |