Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | GABRR1 | P24046 | 2/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MME | P08473 | 2/20 | 0.32 |
| ▸ | CACNA2D1 | P54289 | 2/20 | 0.31 |
| ▸ | CACNB3 | P54284 | 1/20 | 0.31 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.31 |
| ▸ | PGR | P06401 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | CACNA2D2 | Q9NY47 | 1/20 | 0.31 |
| ▸ | OR51E2 | Q9H255 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | FOLH1 | Q04609 | 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 | |
|---|---|---|---|---|
| SCHEMBL8877183 | 0.87 | SLC22A6 (0.43) | SLC22A6TDP1SMN1; SMN2GABRR1LMNA | |
| SCHEMBL27823940 | 0.81 | DPP4 (0.37) | SLC22A6TDP1SMN1; SMN2GABRR1LMNA | |
| SCHEMBL27464365 | 0.80 | SLC22A6 (0.38) | SLC22A6TDP1SMN1; SMN2GABRR1LMNA | |
| SCHEMBL27824024 | 0.79 | TSHR (0.38) | SLC22A6TDP1SMN1; SMN2TSHRFOLH1 | |
| SCHEMBL1604218 | 0.78 | SLC22A6 (0.36) | SLC22A6TDP1SMN1; SMN2GABRR1CACNA2D1 | |
| SCHEMBL13560304 | 0.78 | CETP (0.33) | TDP1LMNAALDH1A1TSHR | |
| SCHEMBL28474842 | 0.78 | GABRR1 (0.46) | SLC22A6TDP1SMN1; SMN2GABRR1LMNA | |
| SCHEMBL27306328 | 0.76 | SLC22A6 (0.35) | SLC22A6TDP1SMN1; SMN2GABRR1LMNA | |
| SCHEMBL10717814 | 0.76 | LMNA (0.31) | SLC22A6TDP1LMNATSHR | |
| SCHEMBL23829965 | 0.75 | SLC22A6 (0.38) | SLC22A6TDP1SMN1; SMN2GABRR1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| CN-104447416-A | Method for preparing 3-tert-butyl oxanamide-4,4,4-trifluoro-methyl butyrate | UNIV JILIN | 2015-03-25 | — | — | CN | disclosed |