Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.32 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.32 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | HTR2B | P41595 | 1/20 | 0.32 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL6439563 | 0.81 | SLC22A6 (0.43) | SLC22A6CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL6439560 | 0.81 | SLC22A6 (0.43) | SLC22A6CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL14047881 | 0.79 | SLC6A2 (0.44) | — | |
| SCHEMBL614363 | 0.77 | — | — | |
| SCHEMBL8147302 | 0.77 | — | — | |
| SCHEMBL8017579 | 0.75 | ITGB3 (0.32) | SLC22A6CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL8017578 | 0.75 | ITGB3 (0.32) | SLC22A6CACNA2D1CACNB3CACNA1CPGR | |
| SCHEMBL5536864 | 0.75 | — | — | |
| SCHEMBL6725633 | 0.75 | — | — | |
| SCHEMBL14865320 | 0.75 | — | — |
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-2012076842-A1 | SYNTHETIC RETINOIDS FOR CONTROL OF CELL DIFFERENTIATION | UNIVERSITY OF DURHAM (GB) | 2012-06-14 | — | — | WO | disclosed |