Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | GSTP1 | P09211 | 1/20 | 0.42 |
| ▸ | GSTM2 | P28161 | 1/20 | 0.42 |
| ▸ | CA12 | O43570 | 2/20 | 0.41 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA9 | Q16790 | 2/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | GLS | O94925 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9498594 | 0.99 | GSTP1 (0.42) | MAPTHRH3KMT2AMEN1GSTP1 | |
| SCHEMBL9795208 | 0.96 | MAPT (0.45) | MAPTHRH3KMT2AMEN1GSTP1 | |
| SCHEMBL9795136 | 0.95 | MAPT (0.43) | MAPTHRH3KMT2AMEN1GSTP1 | |
| SCHEMBL9499223 | 0.79 | ALDH1A1 (0.41) | MAPTKMT2AMEN1CA12CA1 | |
| SCHEMBL9345110 | 0.78 | CNR1 (0.43) | CA12CA1CA2CA9 | |
| Fumaric Acid SCHEMBL9795227 | 0.77 | HSD17B10 (0.47) | KMT2AMEN1GSTP1GSTM2KDM4E | |
| SCHEMBL9500025 | 0.76 | TSHR (0.39) | KMT2AMEN1CA12CA1CA2 | |
| SCHEMBL13661591 | 0.75 | MAPT (0.70) | MAPTKMT2AMEN1CA12CA1 | |
| SCHEMBL9633481 | 0.75 | KDM4E (0.62) | MAPTHRH3KMT2AMEN1CA12 | |
| SCHEMBL21998662 | 0.75 | KDM4E (0.62) | MAPTHRH3KMT2AMEN1CA12 |
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 |