Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.44 |
| ▸ | MMP1 | P03956 | 1/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.44 |
| ▸ | TSHR | P16473 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TTR | P02766 | 2/20 | 0.42 |
| ▸ | FOS | P01100 | 1/20 | 0.42 |
| ▸ | JUN | P05412 | 1/20 | 0.42 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.42 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GLA | P06280 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | AR | P10275 | 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 | |
|---|---|---|---|---|
| SCHEMBL7954853 | 0.85 | TAAR1 (0.42) | CYP3A4MMP1TAAR1TSHRMAPK1 | |
| SCHEMBL7928896 | 0.85 | SMPD1 (0.48) | CYP3A4GLASMPD1 | |
| SCHEMBL29521379 | 0.83 | REN (0.48) | TDP1SMPD1 | |
| SCHEMBL3080203 | 0.83 | TSHR (0.44) | TSHRTTRALDH1A1TDP1 | |
| SCHEMBL2810242 | 0.83 | REN (0.48) | TDP1SMPD1 | |
| SCHEMBL16981129 | 0.83 | GABRA1 (0.43) | CYP3A4MMP1TAAR1TSHRMAPK1 | |
| SCHEMBL4746647 | 0.82 | SLC6A4 (0.49) | TSHRMAPK1LMNAALDH1A1TDP1 | |
| SCHEMBL3071677 | 0.82 | CYP4F2 (0.54) | TTRALDH1A1TDP1 | |
| SCHEMBL8285816 | 0.82 | ALDH1A1 (0.43) | CYP3A4MAPK1TTRLMNAALDH1A1 | |
| SCHEMBL3977247 | 0.81 | L3MBTL1 (0.41) | ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010024772-A1 | ASPARTYL PROTEASE INHIBITORS | MEDIVIR AB (SE) | 2010-03-04 | — | — | WO | disclosed |