Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 2/20 | 0.56 |
| ▸ | PARP1 | P09874 | 6/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.50 |
| ▸ | CA12 | O43570 | 2/20 | 0.50 |
| ▸ | CA9 | Q16790 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | TTK | P33981 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | TYMP | P19971 | 2/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.35 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | PARG | Q86W56 | 1/20 | 0.33 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.33 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7029179 | 0.84 | PARP1 (0.48) | KIF11PARP1KDM4ECA12CA9 | |
| SCHEMBL7022549 | 0.81 | PARP1 (0.46) | KIF11PARP1KDM4ECA12CA9 | |
| SCHEMBL7022550 | 0.81 | PARP1 (0.46) | KIF11PARP1KDM4ECA12CA9 | |
| SCHEMBL29519732 | 0.80 | KIF11 (0.48) | KIF11KDM4EALDH1A1CYP2A6PDE3B | |
| SCHEMBL1418732 | 0.80 | KIF11 (0.48) | KIF11KDM4EALDH1A1CYP2A6PDE3B | |
| SCHEMBL28589579 | 0.80 | KIF11 (0.81) | KIF11KDM4EALDH1A1CYP2A6TTK | |
| SCHEMBL3380432 | 0.80 | KDM4E (0.53) | KIF11PARP1KDM4ECA12CA9 | |
| SCHEMBL3380424 | 0.80 | KDM4E (0.53) | KIF11PARP1KDM4ECA12CA9 | |
| SCHEMBL7033757 | 0.77 | TYMP (0.43) | KIF11PARP1KDM4ECA12CA9 | |
| SCHEMBL7033759 | 0.77 | TYMP (0.43) | KIF11PARP1KDM4ECA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010046388-A1 | SUBSTITUTED (AZA) -1-METHYL-1H-QUINOLIN-2-ONES AS ANTIBACTERIALS | GLAXO GROUP LIMITED (GB) | 2010-04-29 | — | — | WO | disclosed |
| WO-2010046388-A1 | SUBSTITUTED (AZA) -1-METHYL-1H-QUINOLIN-2-ONES AS ANTIBACTERIALS | GLAXO GROUP LIMITED (GB) | 2010-04-29 | — | — | WO | disclosed |