Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SHBG | P04278 | 1/20 | 0.40 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.39 |
| ▸ | PGR | P06401 | 2/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | KCNN4 | O15554 | 3/20 | 0.37 |
| ▸ | ESR1 | P03372 | 2/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL42933 | 0.80 | SHBG (0.60) | TAAR1ALDH1A1TSHRMAPK1SHBG | |
| SCHEMBL2270630 | 0.78 | TAAR1 (0.56) | TAAR1ALDH1A1TSHRMAPK1SHBG | |
| Water SCHEMBL28217447 | 0.78 | SHBG (0.58) | TAAR1ALDH1A1TSHRMAPK1SHBG | |
| SCHEMBL17899832 | 0.77 | CYP2C19 (0.43) | TAAR1ALDH1A1TSHRMAPK1NR3C1 | |
| SCHEMBL29291029 | 0.76 | TAAR1 (0.54) | TAAR1ALDH1A1MAPK1SHBGNR3C1 | |
| SCHEMBL7765635 | 0.76 | TAAR1 (0.54) | TAAR1ALDH1A1TSHRMAPK1SHBG | |
| SCHEMBL21245467 | 0.76 | TAAR1 (0.54) | TAAR1ALDH1A1MAPK1SHBGNR3C1 | |
| SCHEMBL19981048 | 0.76 | TAAR1 (0.54) | TAAR1ALDH1A1TSHRMAPK1SHBG | |
| SCHEMBL9250206 | 0.76 | TAAR1 (0.54) | TAAR1ALDH1A1TSHRMAPK1SHBG | |
| SCHEMBL19033678 | 0.76 | TAAR1 (0.60) | TAAR1ALDH1A1MAPK1SHBGCYP2C19 |
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-117263920-A | Organic laser gain medium material based on dibenzofuran and phenanthroimidazole and preparation method and application thereof | 华南理工大学 | 2023-12-22 | — | — | CN | disclosed |
| EP-0674651-B1 | SUBSTITUTED 6-AZAANDROSTENONES | GLAXO WELLCOME INC (US) | 1998-10-28 | — | — | EP | disclosed |
| US-5708001-A | TESTOSTERONE-5A-REDUCTASE INHIBITORS | GLAXO WELLCOME INC. (US) | 1998-01-13 | — | — | US | disclosed |
| WO-1994014833-A2 | SUBSTITUTED 6-AZAANDROSTENONES | GLAXO WELLCOME INC. (US) | 1994-07-07 | — | — | WO | disclosed |