Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.31 |
| ▸ | CA12 | O43570 | 2/20 | 0.31 |
| ▸ | CA6 | P23280 | 2/20 | 0.31 |
| ▸ | CA7 | P43166 | 2/20 | 0.31 |
| ▸ | CA9 | Q16790 | 2/20 | 0.31 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.31 |
| ▸ | CA5B | Q9Y2D0 | 2/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.30 |
| ▸ | LMNA | P02545 | 2/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL8789959 | 0.84 | CYP2C9 (0.39) | CYP2C9CYP2C19ACE2ALDH1A1ALOX15 | |
| Tempol Hydroxylamine SCHEMBL3946306 | 0.78 | GAA (0.39) | CYP2C9CYP2C19ACE2ALDH1A1ALOX15 | |
| SCHEMBL13202057 | 0.74 | CA12 (0.37) | ACE2ALDH1A1ALOX15CA12CA6 | |
| Tempol Hydroxylamine SCHEMBL27621676 | 0.72 | GAA (0.34) | ACE2ALDH1A1ALOX15CA12CA6 | |
| Tempol Hydroxylamine SCHEMBL2858010 | 0.72 | GAA (0.34) | ACE2ALDH1A1ALOX15CA12CA6 | |
| SCHEMBL27648896 | 0.71 | GAA (0.45) | ACE2ALDH1A1CA12CA6CA7 | |
| SCHEMBL5697706 | 0.69 | GAA (0.39) | KMT2AGAAL3MBTL1 | |
| Acetic Acid SCHEMBL27621684 | 0.69 | KDM4E (0.43) | ALOX15KMT2AGAA | |
| Acetic Acid SCHEMBL2864226 | 0.69 | KDM4E (0.43) | ALOX15KMT2AGAA | |
| SCHEMBL11203248 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1216269-A1 | POLYMERIC STABILIZERS WITH HIGH AFFINITY TO PULP | Ciba SC Holding AG (CH) | 2002-06-26 | — | — | EP | disclosed |
| EP-1212486-A1 | CHLOROHYDRIN AND CATIONIC COMPOUNDS HAVING HIGH AFFINITY FOR PULP OR PAPER | Ciba SC Holding AG (CH) | 2002-06-12 | — | — | EP | disclosed |
| WO-2001019897-A1 | POLYMERIC STABILIZERS WITH HIGH AFFINITY TO PULP | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2001-03-22 | — | — | WO | disclosed |
| WO-2001020078-A1 | CHLOROHYDRIN AND CATIONIC COMPOUNDS HAVING HIGH AFFINITY FOR PULP OR PAPER | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2001-03-22 | — | — | WO | disclosed |