Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 4/20 | 0.61 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | AR | P10275 | 4/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.36 |
| ▸ | MMP2 | P08253 | 1/20 | 0.36 |
| ▸ | MMP9 | P14780 | 1/20 | 0.36 |
| ▸ | MMP13 | P45452 | 1/20 | 0.36 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | DRD2 | P14416 | 1/20 | 0.36 |
| ▸ | DRD3 | P35462 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1286795 | 0.76 | SCN9A (1.00) | SCN9AMMP2MMP9ALDH1A1HTT | |
| SCHEMBL10072357 | 0.74 | SCN9A (0.88) | SCN9ATSHRALDH1A1HTT | |
| SCHEMBL8273448 | 0.74 | TSHR (0.40) | SCN9ATSHRARL3MBTL1AKR1C3 | |
| SCHEMBL1709219 | 0.72 | SCN9A (0.74) | SCN9ADRD4ALDH1A1 | |
| SCHEMBL1709226 | 0.72 | SCN9A (1.00) | SCN9ADRD4MMP2MMP9ALDH1A1 | |
| SCHEMBL1286785 | 0.71 | SCN9A (1.00) | SCN9AHTT | |
| SCHEMBL1709244 | 0.70 | SCN9A (0.66) | SCN9ATSHRL3MBTL1HTTDRD2 | |
| SCHEMBL10072168 | 0.70 | SCN9A (0.56) | SCN9ADRD4ALDH1A1 | |
| SCHEMBL8273444 | 0.69 | ADAM17 (0.49) | MMP2MMP13 | |
| SCHEMBL1286845 | 0.69 | SCN9A (0.66) | SCN9ADRD4ALDH1A1 |
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-2012047703-A2 | CYCLOPROPYL-SPIRO-PIPERIDINES USEFUL AS SODIUM CHANNEL BLOCKERS | SCHERING CORPORATION (US) | 2012-04-12 | — | — | WO | disclosed |