Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.66 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.66 |
| ▸ | NR3C1 | P04150 | 6/20 | 0.48 |
| ▸ | AR | P10275 | 5/20 | 0.48 |
| ▸ | PGR | P06401 | 5/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | SHBG | P04278 | 2/20 | 0.47 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | ESR1 | P03372 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.41 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9624036 | 1.00 | ALDH1A1 (0.66) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL9623240 | 0.84 | ALDH1A1 (0.48) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL9623243 | 0.84 | ALDH1A1 (0.48) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL6387525 | 0.82 | ALDH1A1 (0.70) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL9624042 | 0.82 | KDM4E (0.67) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL3363905 | 0.81 | SHBG (0.50) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL3363910 | 0.81 | SHBG (0.50) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL8940013 | 0.81 | SHBG (0.50) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL3363903 | 0.81 | SHBG (0.50) | ALDH1A1MAPK1NR3C1ARPGR | |
| SCHEMBL8940014 | 0.81 | SHBG (0.50) | ALDH1A1MAPK1NR3C1ARPGR |
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-0268400-B1 | STEROIDAL 17ALPHA-SILYL ETHERS AND PROCESS TO CORTICOIDS AND PROGESTERONES | THE UPJOHN COMPANY (US) | 1992-04-29 | — | — | EP | claimed |