Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAF1 | P04049 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDR | P35968 | 3/20 | 0.40 |
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | LIPE | Q05469 | 4/20 | 0.39 |
| ▸ | RAPGEF3 | O95398 | 1/20 | 0.39 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | PPARD | Q03181 | 1/20 | 0.38 |
| ▸ | PPARA | Q07869 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.37 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9819234 | 0.97 | RAF1 (0.43) | RAF1MAPTKDM4EMAPK1KDR | |
| SCHEMBL9819086 | 0.85 | RAPGEF3 (0.40) | MAPTRAPGEF3RAPGEF4MEN1HTT | |
| SCHEMBL9819360 | 0.85 | RAPGEF3 (0.43) | MAPTMAPK1RAPGEF3RAPGEF4PPARG | |
| SCHEMBL9819062 | 0.83 | TRPV1 (0.49) | MAPTKDM4EMAPK1KDRBRAF | |
| SCHEMBL9819084 | 0.82 | MAPT (0.51) | MAPTMAPK1MEN1HTTRAB9A | |
| SCHEMBL9819198 | 0.79 | ENPP3 (0.49) | MAPTRAPGEF3RAPGEF4MEN1HTT | |
| SCHEMBL9819139 | 0.79 | TRPV1 (0.44) | MAPTKDRBRAFMAPK14 | |
| SCHEMBL9819159 | 0.77 | NPC1 (0.48) | MAPTKDM4EKDRHTTRAB9A | |
| SCHEMBL9818887 | 0.76 | IDO1 (0.47) | MAPTKDM4ERAPGEF3RAPGEF4PPARG | |
| SCHEMBL9818928 | 0.76 | EPHX2 (0.50) | RAPGEF3RAPGEF4RAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5034410-A | Nitrile and oxo containing amides or thioamides | SYNTEX (U.S.A.) INC. (US) | 1991-07-23 | — | — | US | disclosed |