Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1313231 | 0.79 | SMYD3 (0.44) | SMYD3 | |
| Hydrochloric Acid SCHEMBL19995691 | 0.78 | SMYD3 (0.43) | SMYD3 | |
| SCHEMBL21551515 | 0.75 | SMYD3 (0.44) | SMYD3 | |
| SCHEMBL21551513 | 0.73 | SMYD3 (0.43) | SMYD3 | |
| SCHEMBL28543808 | 0.73 | SMYD3 (0.43) | SMYD3 | |
| SCHEMBL17780232 | 0.71 | KDM4E (0.38) | SMYD3 | |
| SCHEMBL17962760 | 0.71 | SMYD3 (0.42) | SMYD3 | |
| SCHEMBL21551460 | 0.71 | SMYD3 (0.45) | SMYD3 | |
| Hydrochloric Acid SCHEMBL9177661 | 0.70 | KDM4E (0.36) | SMYD3 | |
| SCHEMBL15286298 | 0.69 | SMYD3 (0.41) | SMYD3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016042453-A1 | N-(HETERO)ARYL-SUBSTITUTED HETEROYCLIC DERIVATIVES USEFUL FOR THE TREATMENT OF DISEASES OR CONDITIONS RELATED TO THE CENTRAL NERVOUS SYSTEM | SHIRE INTERNATIONAL GMBH (CH) | 2016-03-24 | — | — | WO | disclosed |