Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.35 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.35 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.35 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | HTR2B | P41595 | 1/20 | 0.35 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CHRNB2 | P17787 | 6/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 6/20 | 0.34 |
| ▸ | CHRNB4 | P30926 | 5/20 | 0.34 |
| ▸ | CHRNA3 | P32297 | 3/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL103866 | 0.84 | — | — | |
| SCHEMBL105805 | 0.84 | — | — | |
| Hydrochloric Acid SCHEMBL4578644 | 0.82 | CHRNB2 (0.40) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL17772958 | 0.80 | SLC22A6 (0.38) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL22383993 | 0.78 | SLC22A6 (0.42) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL7963498 | 0.77 | SLC22A6 (0.39) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL23222793 | 0.76 | SLC22A6 (0.35) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL22384009 | 0.76 | TDP1 (0.39) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL19737289 | 0.76 | RNPEP (0.38) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL20041198 | 0.75 | GPR84 (0.35) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C |
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-3220914-B1 | NANOMATERIAL COMPOSITIONS, SYNTHESIS, AND ASSEMBLY | RHODE ISLAND HOSPITAL (US) | 2020-09-02 | — | — | EP | disclosed |