Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 3/20 | 0.55 |
| ▸ | CES1 | P23141 | 3/20 | 0.55 |
| ▸ | SIGMAR1 | Q99720 | 9/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.50 |
| ▸ | MMP2 | P08253 | 1/20 | 0.49 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | MMP8 | P22894 | 1/20 | 0.49 |
| ▸ | MMP13 | P45452 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.48 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL31038120 | 1.00 | FAAH (0.55) | FAAHCES1SIGMAR1MAOAMMP2 | |
| SCHEMBL9192045 | 0.98 | MAOA (0.52) | FAAHCES1SIGMAR1MAOAMMP2 | |
| SCHEMBL8082932 | 0.91 | FAAH (0.48) | FAAHCES1SIGMAR1MAOAMMP2 | |
| SCHEMBL20563012 | 0.89 | FAAH (0.47) | FAAHCES1SIGMAR1MAOAMMP2 | |
| SCHEMBL17388609 | 0.85 | FAAH (0.44) | FAAHCES1SIGMAR1MAOAMMP2 | |
| SCHEMBL22296453 | 0.83 | FAAH (0.51) | FAAHCES1SIGMAR1MAOAMAPT | |
| SCHEMBL17288637 | 0.83 | FAAH (0.51) | FAAHCES1SIGMAR1MAOAMAPT | |
| SCHEMBL17288469 | 0.83 | FAAH (0.51) | FAAHCES1SIGMAR1MAOAMAPT | |
| SCHEMBL144712 | 0.81 | ALDH1A1 (0.48) | FAAHCES1MAOAMAOB | |
| SCHEMBL7931693 | 0.81 | FFAR1 (0.49) | FAAH |
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 |
|---|---|---|---|---|---|---|---|
| CN-104945298-B | Trifluoromethyl thioperoxide and preparation method thereof | 中国科学院上海有机化学研究所 | 2016-09-07 | — | — | CN | disclosed |
| CN-104945298-A | Trifluoromethyl thioperoxide and preparation method thereof | SHANGHAI INST ORGANIC CHEM | 2015-09-30 | — | — | CN | disclosed |