Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP24A1 | Q07973 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PSMD10 | O75832 | 1/20 | 0.36 |
| ▸ | SMYD2 | Q9NRG4 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.36 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.36 |
| ▸ | VDR | P11473 | 1/20 | 0.35 |
| ▸ | STAT3 | P40763 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL13670636 | 0.99 | CYP24A1 (0.39) | CYP24A1CYP3A4CYP2C19PSMD10SMYD2 | |
| SCHEMBL3290837 | 0.97 | CYP24A1 (0.40) | CYP24A1CYP3A4CYP2C19PSMD10SMYD2 | |
| SCHEMBL4951192 | 0.92 | CYP3A4 (0.38) | CYP24A1CYP3A4CYP2C19SMYD2HTT | |
| SCHEMBL3021239 | 0.89 | CYP3A4 (0.36) | CYP24A1CYP3A4CYP2C19SMYD2HTT | |
| SCHEMBL3409599 | 0.89 | CYP3A4 (0.36) | CYP24A1CYP3A4CYP2C19SMYD2HTT | |
| SCHEMBL18290138 | 0.89 | CYP3A4 (0.33) | CYP24A1CYP3A4CYP2C19SMYD2HTT | |
| SCHEMBL5273167 | 0.86 | CYP24A1 (0.38) | CYP24A1CYP3A4CYP2C19PSMD10HTT | |
| SCHEMBL23540090 | 0.84 | KMT2A (0.34) | CYP24A1CYP3A4CYP2C19SMYD2HTT | |
| SCHEMBL13250784 | 0.84 | KEAP1 (0.36) | CYP24A1CYP3A4CYP2C19SMYD2HTT | |
| SCHEMBL20601810 | 0.84 | CYP3A4 (0.37) | CYP3A4CYP2C19HTTSMN1; SMN2KEAP1 |
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 |