Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 3/20 | 0.34 |
| ▸ | ACHE | P22303 | 1/20 | 0.34 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TMEM97 | Q5BJF2 | 5/20 | 0.32 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.32 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.31 |
| ▸ | TTPA | P49638 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 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 | |
|---|---|---|---|---|
| SCHEMBL9332542 | 0.93 | BCHE (0.37) | KMT2ABCHEEPHX1TMEM97 | |
| SCHEMBL9330153 | 0.80 | EPHX1 (0.38) | BCHEEPHX1ALDH1A1TDP1OPRM1 | |
| SCHEMBL9333237 | 0.79 | SMN1; SMN2 (0.47) | MEN1KMT2AEPHX1ALDH1A1 | |
| SCHEMBL9329979 | 0.78 | THRB (0.30) | — | |
| SCHEMBL9333430 | 0.78 | CHRM3 (0.38) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| Fumaric Acid SCHEMBL9344148 | 0.74 | FKBP1A (0.35) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL9344131 | 0.72 | SMN1; SMN2 (0.43) | KMT2AHSD17B10ALDH1A1TSHR | |
| SCHEMBL9330164 | 0.72 | CHRM3 (0.46) | BCHEEPHX1TMEM97CHRM3 | |
| SCHEMBL9330841 | 0.72 | SMN1; SMN2 (0.48) | MEN1KMT2ABCHEEPHX1 | |
| SCHEMBL8680907 | 0.72 | EPHX1 (0.53) | KMT2ABCHEACHEEPHX1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0366004-B1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | BOEHRINGER MANNHEIM GMBH (DE) | 1994-03-30 | — | — | EP | disclosed |
| EP-0366004-A1 | Cyclic azaaliphatic compounds with a nitroxy group, process for their preparation and pharmaceutical compositions thereof | Roche Diagnostics GmbH (DE) | 1990-05-02 | — | — | EP | disclosed |