Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 3/20 | 0.56 |
| ▸ | MAOA | P21397 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 6/20 | 0.50 |
| ▸ | MEN1 | O00255 | 4/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.46 |
| ▸ | CTSV | O60911 | 1/20 | 0.45 |
| ▸ | CTSL | P07711 | 1/20 | 0.45 |
| ▸ | AR | P10275 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| Acetonitrile SCHEMBL28336082 | 0.84 | MAOB (0.62) | MAOBMAOAMAPTMEN1KMT2A | |
| Acetonitrile SCHEMBL9823789 | 0.83 | MAOB (0.56) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL15545212 | 0.83 | GAA (0.61) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL30443578 | 0.83 | MAOB (0.63) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL2965418 | 0.83 | MAOB (0.63) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL2960397 | 0.82 | MAPT (0.66) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL9795659 | 0.82 | MAOB (0.62) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL25920598 | 0.82 | MAPT (0.62) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL18429630 | 0.82 | APP (0.59) | MAOBMAOAMAPTMEN1KMT2A | |
| SCHEMBL18304358 | 0.82 | MAOB (0.62) | MAOBMAOAMAPTMEN1KMT2A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0658542-B1 | PROCESS FOR PRODUCING ALPHA-HYDROXYIMINOPHENYLACETONITRILE | SHIONOGI & CO (JP) | 1998-01-14 | — | — | EP | disclosed |
| US-5629442-A | REACTION OF NITRILE WITH ALKYL NITRITE TO FORM OXIME SUBSTITUTED PHENYLACETONITRILE | SHIONOGI & CO., LTD. | 1997-05-13 | — | — | US | disclosed |
| EP-0658542-A1 | PROCESS FOR PRODUCING $g(a)-HYDROXYIMINOPHENYLACETONITRILE | SHIONOGI & CO., LTD. (JP) | 1995-06-21 | — | — | EP | disclosed |