Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | QPCT | Q16769 | 6/20 | 0.47 |
| ▸ | NAMPT | P43490 | 1/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.41 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.41 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.41 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.41 |
| ▸ | MELK | Q14680 | 1/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.39 |
| ▸ | F2 | P00734 | 1/20 | 0.39 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | STAT6 | P42226 | 1/20 | 0.38 |
| ▸ | P2RY14 | Q15391 | 1/20 | 0.38 |
| ▸ | PAK4 | O96013 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4904991 | 0.92 | ROCK2 (0.39) | QPCTNAMPTTP53MAPTRAB9A | |
| SCHEMBL4596911 | 0.89 | NAMPT (0.47) | QPCTNAMPTTP53MAPTRAB9A | |
| SCHEMBL4905587 | 0.81 | ROCK1 (0.48) | QPCTNAMPTKDRPDGFRBIP6K1 | |
| SCHEMBL4597942 | 0.81 | KDR (0.40) | QPCTRAB9AF2PRSS1L3MBTL1 | |
| SCHEMBL14066719 | 0.80 | IP6K1 (0.55) | QPCTNAMPTTP53MAPTRAB9A | |
| SCHEMBL4598401 | 0.79 | KDR (0.47) | QPCTNAMPTTP53MAPTRAB9A | |
| SCHEMBL4597328 | 0.77 | AURKB (0.47) | QPCTNAMPTTP53MAPTRAB9A | |
| SCHEMBL4373012 | 0.76 | FLT4 (0.60) | KDRPLK4CHEK1DAPK3ROCK2 | |
| SCHEMBL30673017 | 0.76 | TBXA2R (0.47) | KDRCHEK1MAP4K4CHEK2PRKCG | |
| SCHEMBL4598966 | 0.76 | CDK1 (0.42) | QPCTNAMPTTP53MAPTRAB9A |
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-1910312-A1 | QUADRATIC ACID II DERIVATIVES | Merck Patent GmbH (DE) | 2008-04-16 | — | — | EP | claimed |
| WO-2007014608-A1 | QUADRATIC ACID II DERIVATIVES | MERCK PATENT GMBH (DE) | 2007-02-08 | — | — | WO | claimed |