Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.47 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.46 |
| ▸ | COMT | P21964 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.42 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.41 |
| ▸ | WNT3A | P56704 | 4/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 4/20 | 0.41 |
| ▸ | TNKS | O95271 | 3/20 | 0.41 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.41 |
| ▸ | CDK1 | P06493 | 1/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.41 |
| ▸ | GSK3A | P49840 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.39 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | TDP2 | O95551 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL17151369 | 0.81 | SCN4A (0.46) | NOTUMGSK3B | |
| SCHEMBL11094847 | 0.81 | PDPK1 (0.52) | CDK1GSK3BEPHX2 | |
| Hydrochloric Acid SCHEMBL30015576 | 0.80 | SCN4A (0.45) | NOTUMGSK3B | |
| SCHEMBL5070318 | 0.78 | KDR (0.41) | TNKS2TNKSPARP1 | |
| SCHEMBL4787445 | 0.78 | SCN4A (0.48) | CDK1GSK3BPARP1 | |
| SCHEMBL2473305 | 0.78 | KMT2A (0.42) | NOTUMCOMTNISCHTNKS2TNKS | |
| SCHEMBL28815828 | 0.78 | RPS6KA3 (0.47) | GSK3B | |
| SCHEMBL918364 | 0.77 | SCN4A (0.52) | NOTUMCDK1GSK3BPARP1 | |
| Hydrochloric Acid SCHEMBL29878808 | 0.76 | RPS6KA3 (0.46) | GSK3B | |
| SCHEMBL1456892 | 0.76 | HCAR2 (0.41) | NOTUMPARP1 |
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-2403854-A1 | SULFONYLATED TETRAHYDROAZOLOPYRAZINES AND THEIR USE AS MEDICINAL PRODUCTS | Grünenthal GmbH (DE) | 2012-01-11 | — | — | EP | disclosed |
| WO-2010099938-A1 | SULFONYLATED TETRAHYDROAZOLOPYRAZINES AND THEIR USE AS MEDICINAL PRODUCTS | Grünenthal GmbH (DE) | 2010-09-10 | — | — | WO | disclosed |