Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 4/20 | 0.66 |
| ▸ | CLK4 | Q9HAZ1 | 6/20 | 0.49 |
| ▸ | DYRK1B | Q9Y463 | 3/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | CA12 | O43570 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.42 |
| ▸ | PIM1 | P11309 | 3/20 | 0.42 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.42 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.42 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 8/20 | 0.42 |
| ▸ | AURKA | O14965 | 4/20 | 0.42 |
| ▸ | NTRK2 | Q16620 | 3/20 | 0.41 |
| ▸ | NTRK1 | P04629 | 3/20 | 0.41 |
| ▸ | FLT3 | P36888 | 3/20 | 0.41 |
| ▸ | PLK4 | O00444 | 2/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.41 |
| ▸ | MAP4K4 | O95819 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL832168 | 0.80 | PARP1 (1.00) | PARP1CLK4DYRK1BFYNCA12 | |
| SCHEMBL29688203 | 0.80 | PARP1 (1.00) | PARP1CLK4DYRK1BFYNCA12 | |
| SCHEMBL14463935 | 0.73 | PARP1 (0.66) | PARP1CDK5LRRK2ROS1NPSR1 | |
| SCHEMBL20340678 | 0.73 | ALDH1A1 (0.65) | PARP1 | |
| SCHEMBL148819 | 0.71 | PARP10 (0.68) | PARP1CLK4DYRK1BFYNCA12 | |
| Ethane SCHEMBL27832823 | 0.69 | PARP10 (0.66) | PARP1CLK4DYRK1BFYNCA12 | |
| SCHEMBL14072522 | 0.69 | PARP1 (0.53) | PARP1CLK4DYRK1BFYNCA12 | |
| SCHEMBL27638376 | 0.68 | CA12 (0.70) | PARP1CLK4DYRK1BFYNCA12 | |
| SCHEMBL13319595 | 0.67 | ALDH1A1 (0.61) | PARP1 | |
| SCHEMBL9475196 | 0.67 | PARP1 (0.68) | PARP1CLK4DYRK1BCA12CA9 |
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 |
|---|---|---|---|---|---|---|---|
| US-10011714-B2 | Monolayer carbon dioxide barrier PET bottles | PLASTIPAK PACKAGING, INC. (US) | 2018-07-03 | — | — | US | disclosed |