Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.51 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.47 |
| ▸ | APP | P05067 | 1/20 | 0.46 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | ACE | P12821 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL16673203 | 0.83 | TDP1 (0.53) | TDP1ALOX5APPHCAR2ESR1 | |
| SCHEMBL869610 | 0.82 | DGKA (0.39) | TDP1L3MBTL1ALDH1A1CYP3A4TSHR | |
| SCHEMBL114173 | 0.81 | TDP1 (0.58) | TDP1ALOX5APPHCAR2ESR1 | |
| SCHEMBL5907642 | 0.80 | TDP1 (0.56) | TDP1ALOX5APPHCAR2ESR1 | |
| SCHEMBL6050179 | 0.80 | TDP1 (0.56) | TDP1ALOX5APPHCAR2ESR1 | |
| Phenethyl Propionate SCHEMBL114088 | 0.79 | TDP1 (0.63) | TDP1ALOX5APPHCAR2ESR1 | |
| SCHEMBL28505436 | 0.78 | TDP1 (0.58) | TDP1ALOX5APPHCAR2ESR1 | |
| SCHEMBL1171157 | 0.77 | ALDH1A1 (0.38) | L3MBTL1ALDH1A1TP53TSHRMAPK1 | |
| SCHEMBL11670330 | 0.76 | TDP1 (0.56) | TDP1ALOX5APPHCAR2ESR1 | |
| SCHEMBL19105434 | 0.76 | MMP8 (0.48) | TDP1ALOX5HCAR2ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5763465-A | 7-(2-aminoethyl) benzothiazolones | ASTRA PHARMACEUTICALS LIMITED (GB) | 1998-06-09 | — | — | US | disclosed |