Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 1/20 | 0.30 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | THRB | P10828 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21283092 | 1.00 | METAP1 (0.30) | METAP1ALDH1A1TP53HSP90AA1CYP3A4 | |
| SCHEMBL19780176 | 0.82 | ALDH1A1 (0.33) | ALDH1A1TP53HSP90AA1CYP3A4THRB | |
| SCHEMBL20852141 | 0.82 | ALDH1A1 (0.33) | ALDH1A1TP53HSP90AA1CYP3A4THRB | |
| SCHEMBL23435713 | 0.78 | ALDH1A1 (0.34) | ALDH1A1TP53HSP90AA1CYP3A4THRB | |
| SCHEMBL26250345 | 0.78 | TSHR (0.40) | ALDH1A1TP53HSP90AA1CYP3A4THRB | |
| SCHEMBL3162144 | 0.77 | ALDH1A1 (0.33) | ALDH1A1TP53HSP90AA1CYP3A4THRB | |
| SCHEMBL11702357 | 0.74 | HPGD (0.41) | ALDH1A1TSHR | |
| SCHEMBL8690851 | 0.74 | TSHR (0.39) | METAP1ALDH1A1CYP3A4TSHR | |
| SCHEMBL22027595 | 0.72 | TSHR (0.44) | METAP1CYP3A4TSHRTDP1 | |
| SCHEMBL598768 | 0.72 | TSHR (0.44) | METAP1CYP3A4TSHRTDP1 |
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-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |