Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 2/20 | 0.38 |
| ▸ | NOS3 | P29474 | 3/20 | 0.36 |
| ▸ | NOS2 | P35228 | 2/20 | 0.35 |
| ▸ | MAPT | P10636 | 2/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | KDM1A | O60341 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.30 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | RELA | Q04206 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6986638 | 0.82 | NOS3 (0.39) | NOS3NOS2MAPTNPC1RAB9A | |
| SCHEMBL6981645 | 0.76 | TRPV3 (0.36) | ALDH1A1L3MBTL1 | |
| SCHEMBL13944940 | 0.74 | NOS3 (0.37) | NOS3NOS2NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL83319 | 0.74 | NPC1 (0.46) | NOS3MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL13944937 | 0.69 | PTGES (0.38) | NOS3MAPTNPC1RAB9AALDH1A1 | |
| SCHEMBL23179843 | 0.69 | TAAR1 (0.43) | NOS3MAPTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL14540777 | 0.69 | NOS3 (0.40) | NOS3NOS2TAAR1CYP2D6MAOA | |
| SCHEMBL14063637 | 0.69 | NOS3 (0.40) | NOS3NOS2TAAR1CYP2D6MAOA | |
| SCHEMBL8063119 | 0.68 | NOS3 (0.35) | NOS3NOS2MAPTRAB9A | |
| SCHEMBL1044907 | 0.66 | TTR (0.52) | MAPTNPC1RAB9ASMN1; SMN2ALDH1A1 |
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-1030850-B1 | AZOLINE DERIVATIVES | NOVARTIS AG (CH) | 2007-09-12 | — | — | EP | disclosed |