Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | THRB | P10828 | 3/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | RECQL | P46063 | 2/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.44 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.40 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL6675019 | 0.79 | ALDH1A1 (0.45) | ALDH1A1MEN1KMT2AMAPTTHRB | |
| SCHEMBL16458103 | 0.77 | ERN1 (0.51) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL29242086 | 0.75 | GPR3 (0.44) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL30958575 | 0.75 | GPR3 (0.44) | ALDH1A1MEN1KMT2AMAPTSMN1; SMN2 | |
| SCHEMBL5887762 | 0.73 | CA4 (0.59) | ALDH1A1KMT2ATDP1KDM4ECYP1A2 | |
| SCHEMBL5887787 | 0.71 | CYP3A4 (0.43) | ALDH1A1MEN1KMT2AMAPTTDP1 | |
| Hydrochloric Acid SCHEMBL28847767 | 0.70 | ALDH1A1 (0.61) | ALDH1A1MEN1KMT2AMAPTTHRB | |
| SCHEMBL3789462 | 0.69 | ALDH1A1 (0.50) | ALDH1A1MEN1KMT2AMAPTTHRB | |
| SCHEMBL234263 | 0.68 | ALDH1A1 (0.64) | ALDH1A1MEN1KMT2AMAPTTHRB | |
| SCHEMBL29387850 | 0.68 | ALDH1A1 (0.64) | ALDH1A1MEN1KMT2AMAPTTHRB |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004047925-A2 | THERAPEUTIC OXIDATION CATALYSTS | EXETER ANTIOXIDANT THERAPEUTICS LIMITED (GB) | 2004-06-10 | — | — | WO | claimed |