Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.39 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | G6PD | P11413 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL15237138 | 1.00 | CYP24A1 (0.40) | CYP24A1CA12CA1CA9NR1I2 | |
| SCHEMBL13491291 | 0.97 | ADORA3 (0.43) | CYP24A1CA12CA1CA9NR1I2 | |
| SCHEMBL23748629 | 0.95 | CYP24A1 (0.39) | CYP24A1CA12CA1CA9ALDH1A1 | |
| SCHEMBL30821470 | 0.93 | ALDH1A1 (0.40) | CYP24A1CA12CA1CA9NR1I2 | |
| SCHEMBL10731427 | 0.92 | ALDH1A1 (0.43) | CYP24A1NR1I2PGRADORA3PTGS2 | |
| SCHEMBL14764654 | 0.91 | CA12 (0.40) | CYP24A1CA12CA1CA9ALDH1A1 | |
| SCHEMBL14764653 | 0.91 | CA12 (0.40) | CYP24A1CA12CA1CA9ALDH1A1 | |
| SCHEMBL15912664 | 0.91 | CA12 (0.40) | CYP24A1CA12CA1CA9ALDH1A1 | |
| SCHEMBL1682134 | 0.88 | FAAH (0.40) | CYP24A1CA12CA1CA9NR1I2 | |
| SCHEMBL1604291 | 0.88 | FAAH (0.40) | CYP24A1CA12CA1CA9NR1I2 |
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-0361341-A2 | Therapeutics for aids based on inhibitors of HIV protease | MILES INC. (US) | 1990-04-04 | — | — | EP | disclosed |