Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.34 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.34 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.34 |
| ▸ | PGR | P06401 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL11140563 | 0.85 | SLC22A6 (0.43) | SLC22A6TSHRSLC6A2SLC6A4BLM | |
| SCHEMBL7334419 | 0.84 | SLC22A6 (0.40) | SLC22A6TSHRSLC6A2SLC6A4BLM | |
| SCHEMBL12447515 | 0.81 | ALDH1A1 (0.46) | TSHRTDP1 | |
| SCHEMBL10458750 | 0.78 | SLC22A6 (0.38) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL27454017 | 0.76 | FFAR1 (0.33) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL8147302 | 0.75 | — | — | |
| SCHEMBL614363 | 0.75 | — | — | |
| SCHEMBL2186782 | 0.74 | TDP1 (0.39) | SLC22A6TSHRSLC6A2SLC6A4BLM | |
| SCHEMBL5516317 | 0.74 | SLC22A6 (0.35) | SLC22A6TDP1CACNA2D1CACNB3CACNA1C | |
| SCHEMBL5518030 | 0.74 | SLC22A6 (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 |
|---|---|---|---|---|---|---|---|
| US-5049577-A | 2-pyrrolidone substituted dihydroxy alkanoic, alkenoic and alkynoic acids, compositions and HMG-CoA reductase inhibition therewith | E. R. SQUIBB & SONS, INC. (US) | 1991-09-17 | — | — | US | disclosed |