Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | FLT3 | P36888 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | IDO1 | P14902 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| 3-Methoxyphenylacetonitrile SCHEMBL103029 | 0.83 | PKM (0.61) | PKMFLT3SMN1; SMN2MEN1NPC1 | |
| 3-Methoxyphenylacetonitrile SCHEMBL27728444 | 0.81 | PKM (0.59) | PKMFLT3SMN1; SMN2MEN1NPC1 | |
| 3-Methoxyphenylacetonitrile SCHEMBL29253102 | 0.81 | PKM (0.59) | PKMFLT3SMN1; SMN2MEN1NPC1 | |
| 3-Methoxyphenylacetonitrile SCHEMBL28155308 | 0.79 | PKM (0.58) | PKMFLT3SMN1; SMN2IDO1ALDH1A1 | |
| SCHEMBL2958835 | 0.79 | KDM4E (0.43) | MAPTHPGDKMT2AIDO1ALDH1A1 | |
| SCHEMBL8193769 | 0.79 | SMN1; SMN2 (0.42) | SMN1; SMN2MAPTIDO1ALDH1A1SLC6A2 | |
| SCHEMBL8992958 | 0.78 | LTA4H (0.59) | PKMFLT3SMN1; SMN2MEN1LMNA | |
| SCHEMBL5004118 | 0.78 | FLT3 (0.57) | PKMFLT3NAAAMEN1POLB | |
| 3-Methoxyphenylacetonitrile SCHEMBL7135147 | 0.76 | LTA4H (0.62) | PKMFLT3SMN1; SMN2NPC1RAB9A | |
| SCHEMBL6933353 | 0.73 | PKM (0.52) | PKMFLT3SMN1; SMN2MEN1NPC1 |
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-5780477-A | Trisubstituted phenyl derivatives and processes for their preparation | CELLTECH THERAPEUTICS, LIMITED (GB) | 1998-07-14 | — | — | US | disclosed |