Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.56 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 7/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | PPARG | P37231 | 1/20 | 0.47 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.42 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.41 |
| ▸ | EGFR | P00533 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL2824448 | 0.83 | MAPT (0.73) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL13761492 | 0.77 | RAB9A (0.53) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL23245914 | 0.77 | RAB9A (0.60) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL1431034 | 0.77 | RAB9A (0.67) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL17254231 | 0.76 | HTR3A (0.40) | RAB9AL3MBTL1SMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL29618414 | 0.76 | RAB9A (0.58) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| Hydrochloric Acid SCHEMBL23245938 | 0.76 | RAB9A (0.58) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL12845203 | 0.75 | RAB9A (0.57) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL14824927 | 0.74 | RAB9A (0.56) | RAB9AL3MBTL1SMN1; SMN2MAPTALDH1A1 | |
| SCHEMBL17987101 | 0.72 | FYN (0.54) | RAB9AL3MBTL1 |
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-2015171489-A1 | METHODS OF MAKING NETUPITANT AND INTERMEDIATES THEREOF | APICORE US LLC (US) | 2015-11-12 | — | — | WO | disclosed |