Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STK17B | O94768 | 1/20 | 0.43 |
| ▸ | CTSA | P10619 | 2/20 | 0.42 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | SLC13A5 | Q86YT5 | 1/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 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 | |
|---|---|---|---|---|
| SCHEMBL15189706 | 0.84 | GSK3B (0.51) | DYRK1AKDM4EMEN1ALDH1A1CYP1A2 | |
| SCHEMBL1167452 | 0.82 | GSK3B (0.47) | STK17BCTSAFFAR1FFAR4DYRK1A | |
| SCHEMBL16612941 | 0.82 | IP6K1 (0.46) | KDM4EALDH1A1CYP1A2XDH | |
| SCHEMBL16612795 | 0.81 | KDM4E (0.43) | FFAR1KDM4EMEN1ALDH1A1CYP1A2 | |
| SCHEMBL16612946 | 0.80 | ADORA2A (0.44) | FFAR4KDM4EMEN1ALDH1A1CYP1A2 | |
| SCHEMBL9899922 | 0.79 | ADORA2A (0.58) | CTSADYRK1AKDM4EMEN1KMT2A | |
| SCHEMBL17746038 | 0.79 | FFAR1 (0.44) | CTSAFFAR1FFAR4DHODHDHFR | |
| SCHEMBL5546097 | 0.78 | ADORA2A (0.54) | KDM4EMEN1ALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL15189624 | 0.78 | MEN1 (0.46) | KDM4EMEN1ALDH1A1KMT2A | |
| SCHEMBL16613030 | 0.78 | KMO (0.42) | FFAR1KDM4EALDH1A1HSD17B10 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2675801-B1 | NOVEL PYRAZOLE AND IMIDAZOLE DERIVATIVES USEFUL AS OREXIN ANTAGONISTS | ACTELION PHARMACEUTICALS LTD (CH) | 2015-04-08 | — | — | EP | claimed |