Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL9501589 | 0.82 | MEN1 (0.32) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL9497890 | 0.81 | CYP2D6 (0.38) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL9499223 | 0.78 | ALDH1A1 (0.41) | MEN1CYP2C19KMT2A | |
| SCHEMBL19861218 | 0.76 | ALDH1A1 (0.35) | MEN1KMT2AHSD17B10 | |
| SCHEMBL9795223 | 0.75 | TSHR (0.40) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL9795173 | 0.75 | TSHR (0.37) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL9500025 | 0.74 | TSHR (0.39) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| Oxalic Acid SCHEMBL9795456 | 0.73 | MEN1 (0.36) | MEN1CYP2C9ALOX15CYP2C19KMT2A | |
| SCHEMBL19861148 | 0.73 | SLC6A5 (0.38) | MEN1KMT2A | |
| SCHEMBL12334732 | 0.72 | MEN1 (0.35) | MEN1CYP2C9ALOX15CYP2C19KMT2A |
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-0367019-B1 | PHARMACEUTICAL COMPOSITIONS CONTAINING NITROXYALKYL AMINE WITH AN AMIDE FUNCTION, AND METHOD FOR THE PREPARATION OF THE COMPOUNDS | Roche Diagnostics GmbH (DE) | 1993-05-12 | — | — | EP | disclosed |
| EP-0367019-A1 | Pharmaceutical compositions containing nitroxyalkyl amine with an amide function, and method for the preparation of the compounds | Roche Diagnostics GmbH (DE) | 1990-05-09 | — | — | EP | disclosed |