Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 7/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.43 |
| ▸ | SOAT1 | P35610 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | MGLL | Q99685 | 1/20 | 0.40 |
| ▸ | PLA2G4C | Q9UP65 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | GGPS1 | O95749 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17079523 | 0.81 | FAAH (0.45) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL17079525 | 0.81 | FAAH (0.45) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL20580465 | 0.78 | TSHR (0.41) | FAAHCES1TRPV1SOAT1MEN1 | |
| SCHEMBL8986844 | 0.78 | TSHR (0.41) | FAAHCES1TRPV1SOAT1MEN1 | |
| SCHEMBL10359788 | 0.76 | FAAH (0.48) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL9629077 | 0.76 | FAAH (0.48) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL23673186 | 0.75 | FAAH (0.52) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL9785179 | 0.75 | FAAH (0.52) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL77403 | 0.75 | FAAH (0.52) | FAAHTRPV1SOAT1MEN1TP53 | |
| SCHEMBL9785182 | 0.75 | FAAH (0.52) | FAAHTRPV1SOAT1MEN1TP53 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2280918-A1 | PRODUCTION OF COMPOUNDS COMPRISING CF3O GROUPS | Merck Patent GmbH (DE) | 2011-02-09 | — | — | EP | disclosed |
| WO-2009141053-A1 | PRODUCTION OF COMPOUNDS COMPRISING CF3O GROUPS | MERCK PATENT GMBH, (DE) | 2009-11-26 | — | — | WO | disclosed |