Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 6/20 | 0.33 |
| ▸ | CA2 | P00918 | 5/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | CA9 | Q16790 | 4/20 | 0.32 |
| ▸ | PARP1 | P09874 | 1/20 | 0.32 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
| ▸ | L3MBTL1 | Q9Y468 | 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 | |
|---|---|---|---|---|
| SCHEMBL9953080 | 1.00 | CA12 (0.33) | CA12CA2KDM4ECA9PARP1 | |
| SCHEMBL10075903 | 1.00 | CA12 (0.33) | CA12CA2KDM4ECA9PARP1 | |
| SCHEMBL9952110 | 0.83 | CA12 (0.50) | CA12CA2KDM4ECA9MEN1 | |
| SCHEMBL18533885 | 0.83 | CA12 (0.50) | CA12CA2KDM4ECA9MEN1 | |
| SCHEMBL9952106 | 0.83 | CA12 (0.50) | CA12CA2KDM4ECA9MEN1 | |
| SCHEMBL15318669 | 0.81 | CA12 (0.43) | CA12KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL20572345 | 0.77 | GRIN1 (0.43) | CA12CA2KDM4EHTTMEN1 | |
| SCHEMBL20572346 | 0.77 | GRIN1 (0.43) | CA12CA2KDM4EHTTMEN1 | |
| SCHEMBL7756754 | 0.77 | ALOX12 (0.46) | KDM4EHTTMEN1ALDH1A1KMT2A | |
| SCHEMBL7756750 | 0.77 | ALOX12 (0.46) | KDM4EHTTMEN1ALDH1A1KMT2A |
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-2655303-A1 | HYDROGENATION OF ESTERS OR CARBONYL GROUPS WITH TETRADENTATE AMINO/IMINO-THIOETHER BASED RUTHENIUM COMPLEXES | Firmenich SA (CH) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012084810-A1 | HYDROGENATION OF ESTERS OR CARBONYL GROUPS WITH TETRADENTATE AMINO/IMINO-THIOETHER BASED RUTHENIUM COMPLEXES | FIRMENICH SA (CH) | 2012-06-28 | — | — | WO | disclosed |