Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.49 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.49 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | TP53 | P04637 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL29129856 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GLAADRA1AADRA1DADRA1B | |
| SCHEMBL30080423 | 1.00 | ALDH1A1 (0.54) | ALDH1A1GLAADRA1AADRA1DADRA1B | |
| SCHEMBL2712808 | 0.82 | ALDH1A1 (0.70) | ALDH1A1GLAADRA1ATDP1SMN1; SMN2 | |
| SCHEMBL30525945 | 0.81 | ALDH1A1 (0.68) | ALDH1A1GLAADRA1ATDP1SMN1; SMN2 | |
| SCHEMBL18812889 | 0.80 | ALDH1A1 (0.62) | ALDH1A1GLAADRA1ATDP1SMN1; SMN2 | |
| SCHEMBL30525943 | 0.79 | ALDH1A1 (0.66) | ALDH1A1GLAADRA1ATDP1SMN1; SMN2 | |
| SCHEMBL14527088 | 0.79 | ALDH1A1 (0.47) | ALDH1A1GLAADRA1AADRA1DADRA1B | |
| SCHEMBL14527087 | 0.78 | ALDH1A1 (0.53) | ALDH1A1GLAADRA1ATDP1SMN1; SMN2 | |
| SCHEMBL14527094 | 0.78 | ALDH1A1 (0.56) | ALDH1A1GLAADRA1ATDP1SMN1; SMN2 | |
| SCHEMBL8993129 | 0.78 | ALDH1A1 (0.64) | ALDH1A1GLAADRA1AADRA1DADRA1B |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118530232-A | Preparation method of (S) -2- (2-phenyl glycidyl ether) thiophene, and product and application thereof | 浙江永太科技股份有限公司 | 2024-08-23 | — | — | CN | disclosed |
| US-7208505-B2 | β3 adrenergic agonists | ELI LILLY AND COMPANY (US) | 2007-04-24 | — | — | US | disclosed |
| US-7208505-B2 | β3 adrenergic agonists | ELI LILLY AND COMPANY (US) | 2007-04-24 | — | — | US | disclosed |
| WO-2002094820-A1 | CRYSTALLINE SALTS OF 2-(4-{2-[2-HYDROXY-3-(2-THIOPHEN-2-YL-PHENOXY)-PROPYLAMINO]-2-METHYL-PROPYL}-PHENOXY)-NICOTINONITRILE | ELI LILLY AND COMPANY (US) | 2002-11-28 | — | — | WO | disclosed |