Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | PAOX | Q6QHF9 | 2/20 | 0.35 |
| ▸ | NOS1 | P29475 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | GLA | P06280 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL9500160 | 0.91 | BCHE (0.41) | BCHEACHEALDH1A1KDM4EMAPT | |
| Fumaric Acid SCHEMBL9795190 | 0.83 | BCHE (0.40) | BCHEACHEALDH1A1 | |
| SCHEMBL9497845 | 0.79 | ALDH1A1 (0.36) | BCHEACHEALDH1A1KDM4EMEN1 | |
| SCHEMBL9498409 | 0.79 | BCHE (0.40) | BCHEACHEALDH1A1KDM4EMAPT | |
| SCHEMBL9499979 | 0.78 | ALDH1A1 (0.38) | BCHEACHEALDH1A1 | |
| SCHEMBL9498682 | 0.78 | PAOX (0.37) | ALDH1A1KDM4EMAPTPAOXNOS1 | |
| SCHEMBL9498485 | 0.77 | ACHE (0.39) | BCHEACHEALDH1A1KDM4EHPGD | |
| SCHEMBL25205403 | 0.76 | BCHE (0.40) | BCHEACHEALDH1A1MAPT | |
| SCHEMBL28674397 | 0.76 | ALDH1A1 (0.39) | BCHEACHEALDH1A1KDM4E | |
| SCHEMBL28655833 | 0.75 | ALDH1A1 (0.38) | BCHEACHEALDH1A1 |
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-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 |
| US-5037849-A | For treatment of heart and circulatory diseases | BOEHRINGER MANNHEIM GMBH (DE) | 1991-08-06 | — | — | US | 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 |