Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FKBP1A | P62942 | 12/20 | 0.59 |
| ▸ | DPP4 | P27487 | 1/20 | 0.53 |
| ▸ | PREP | P48147 | 3/20 | 0.50 |
| ▸ | ACE | P12821 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10343310 | 0.91 | FKBP1A (0.61) | FKBP1APREPACEALDH1A1CYP3A4 | |
| SCHEMBL18806512 | 0.91 | FKBP1A (0.61) | FKBP1APREPACEALDH1A1CYP3A4 | |
| SCHEMBL15371266 | 0.90 | DPP8 (0.57) | FKBP1ADPP4ACE | |
| SCHEMBL8365050 | 0.90 | DPP8 (0.57) | FKBP1ADPP4ACE | |
| SCHEMBL8110892 | 0.90 | DPP8 (0.57) | FKBP1ADPP4ACE | |
| SCHEMBL10402287 | 0.90 | DPP8 (0.57) | FKBP1ADPP4ACE | |
| Hydrochloric Acid SCHEMBL11217224 | 0.90 | FKBP1A (0.60) | FKBP1APREPACEALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL8040977 | 0.90 | FKBP1A (0.60) | FKBP1APREPACEALDH1A1CYP3A4 | |
| Hydrochloric Acid SCHEMBL9034326 | 0.89 | DPP8 (0.56) | FKBP1ADPP4ACE | |
| Hydrochloric Acid SCHEMBL9034318 | 0.89 | DPP8 (0.56) | FKBP1ADPP4ACE |
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-2261232-A2 | Inhibitors of caspases | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2010-12-15 | — | — | EP | disclosed |