Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP3K11 | Q16584 | 3/20 | 0.39 |
| ▸ | TNKS | O95271 | 6/20 | 0.36 |
| ▸ | PARP1 | P09874 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 3/20 | 0.33 |
| ▸ | CNR2 | P34972 | 3/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | EZH2 | Q15910 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.32 |
| ▸ | ACHE | P22303 | 1/20 | 0.32 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.32 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3394483 | 0.84 | TNKS (0.37) | MAP3K11TNKSPARP1HRH3GRM2 | |
| SCHEMBL3392240 | 0.79 | PRKAB2 (0.36) | BRD4MEN1ALDH1A1KMT2A | |
| SCHEMBL4475367 | 0.79 | ADORA2A (0.39) | MEN1ALDH1A1KMT2AGSK3B | |
| SCHEMBL4478743 | 0.79 | SLC2A1 (0.42) | BRD4MEN1ALDH1A1KMT2A | |
| Hydrochloric Acid SCHEMBL3393361 | 0.78 | DHODH (0.41) | GRM2ALDH1A1POLB | |
| SCHEMBL3396963 | 0.78 | MAP3K11 (0.38) | MAP3K11CNR1CNR2BRD4HRH3 | |
| Hydrochloric Acid SCHEMBL3396774 | 0.77 | GRM2 (0.40) | GRM2ACHEALDH1A1 | |
| SCHEMBL4483594 | 0.76 | MEN1 (0.31) | BRD4MEN1KMT2A | |
| SCHEMBL4481795 | 0.75 | ALDH1A1 (0.43) | BRD4MEN1ALDH1A1KMT2AGSK3B | |
| SCHEMBL4474681 | 0.74 | SLC2A1 (0.37) | ALDH1A1 |
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-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | claimed |
| EP-2246329-A1 | 4(1H)-pyridinone derivatives and their use as antimalaria agents | Glaxo Group Limited (GB) | 2010-11-03 | — | — | EP | disclosed |