Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK1 | Q15118 | 14/20 | 0.46 |
| ▸ | MET | P08581 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.41 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.41 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.41 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16735595 | 0.90 | MET (0.54) | PDK1METCYP3A4CYP2C9CYP2B6 | |
| SCHEMBL16735648 | 0.84 | HSP90AA1 (0.43) | PDK1METTP53MCL1RAB9A | |
| SCHEMBL16735638 | 0.81 | MAOB (0.47) | PDK1TP53MCL1PDK2NPC1 | |
| SCHEMBL16735621 | 0.79 | TP53 (0.43) | PDK1METCYP3A4CYP2C9CYP2B6 | |
| SCHEMBL2143889 | 0.79 | ALDH1A1 (0.56) | NPC1RAB9A | |
| SCHEMBL16735606 | 0.78 | PDK1 (0.47) | PDK1TP53MCL1PDK2PDK3 | |
| SCHEMBL21644619 | 0.77 | MET (0.64) | PDK1METCYP3A4CYP2C9CYP2B6 | |
| SCHEMBL16735575 | 0.77 | HSP90AA1 (0.58) | PDK1PDK2PDK3PDK4 | |
| SCHEMBL9188185 | 0.76 | PDK1 (0.68) | PDK1CYP3A4CYP2C9PDK2PDK3 | |
| SCHEMBL1476946 | 0.75 | SMN1; SMN2 (0.61) | PDK1METCYP3A4CYP2C9CYP2B6 |
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-2519505-B1 | TERTIARY 8-HYDROXYQUINOLINE-7-CARBOXAMIDE DERIVATIVES AND USES THEREOF | POLICHEM SA (LU) | 2015-05-27 | — | — | EP | claimed |