Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 3/20 | 0.41 |
| ▸ | CA1 | P00915 | 3/20 | 0.41 |
| ▸ | CA2 | P00918 | 3/20 | 0.41 |
| ▸ | CA9 | Q16790 | 3/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | RAD52 | P43351 | 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 | |
|---|---|---|---|---|
| SCHEMBL9497834 | 1.00 | CA12 (0.41) | CA12CA1CA2CA9HRH3 | |
| SCHEMBL9499990 | 0.90 | GAA (0.44) | HRH3ALDH1A1MEN1KMT2ATSHR | |
| SCHEMBL9498559 | 0.82 | ALOX15 (0.48) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9795139 | 0.81 | CA12 (0.39) | CA12CA1CA2CA9HRH3 | |
| SCHEMBL9497701 | 0.81 | CYP2D6 (0.40) | ALDH1A1KDM4EMEN1POLBKMT2A | |
| Fumaric Acid SCHEMBL9795340 | 0.80 | ALDH1A1 (0.43) | CA12CA1CA2CA9ALDH1A1 | |
| SCHEMBL9795073 | 0.80 | TMEM97 (0.38) | CA12CA1CA2CA9HRH3 | |
| SCHEMBL9499995 | 0.78 | CYP2D6 (0.38) | NPC1 | |
| Fumaric Acid SCHEMBL9795211 | 0.78 | ALOX15 (0.43) | ALDH1A1KDM4EPOLBTMEM97TSHR | |
| SCHEMBL1934698 | 0.78 | CA12 (0.61) | CA12CA1CA2CA9ALDH1A1 |
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 | claimed |
| 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 |