Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | FAAH | O00519 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 3/20 | 0.50 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.49 |
| ▸ | THRB | P10828 | 1/20 | 0.49 |
| ▸ | PPARA | Q07869 | 2/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | RECQL | P46063 | 1/20 | 0.45 |
| ▸ | MMP8 | P22894 | 1/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.43 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.43 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.43 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.43 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8818978 | 1.00 | FAAH (0.50) | FAAHCES1TAAR1THRBPPARA | |
| SCHEMBL8817229 | 1.00 | FAAH (0.50) | FAAHCES1TAAR1THRBPPARA | |
| SCHEMBL20654839 | 0.99 | TAAR1 (0.50) | FAAHCES1TAAR1THRBPPARA | |
| SCHEMBL3489319 | 0.94 | TAAR1 (0.51) | FAAHCES1TAAR1THRBPPARA | |
| SCHEMBL2008727 | 0.88 | TAAR1 (0.53) | TAAR1THRBMAPTALDH1A1RECQL | |
| SCHEMBL7615604 | 0.82 | MMP8 (0.57) | TAAR1THRBPPARAPPARGMAPT | |
| SCHEMBL11137876 | 0.81 | PPARA (0.45) | FAAHCES1TAAR1THRBPPARA | |
| SCHEMBL7712055 | 0.80 | MMP8 (0.55) | TAAR1THRBPPARAPPARGALDH1A1 | |
| SCHEMBL8817760 | 0.80 | FAAH (0.60) | FAAHCES1MAPTRXFP1ALOX5 | |
| SCHEMBL8814986 | 0.80 | FAAH (0.60) | FAAHCES1MAPTRXFP1ALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1997030018-A1 | 2,2-DIFLUOROALKANE CARBOXYLIC ACIDS, PROCESS FOR THEIR PREPARATION AND MEDICAMENTS CONTAINING THE SAME | BOEHRINGER MANNHEIM GMBH (DE) | 1997-08-21 | — | — | WO | disclosed |