Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 4/20 | 1.00 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.36 |
| ▸ | ADAM10 | O14672 | 2/20 | 0.36 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.36 |
| ▸ | MMP2 | P08253 | 2/20 | 0.36 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL10072357 | 0.93 | SCN9A (0.88) | SCN9ACXCR5ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL1709219 | 0.85 | SCN9A (0.74) | SCN9AALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL1709226 | 0.82 | SCN9A (1.00) | SCN9AALDH1A1HRH3MEN1CYP3A4 | |
| SCHEMBL1709228 | 0.81 | SCN9A (0.69) | SCN9AALDH1A1SMN1; SMN2LMNA | |
| SCHEMBL1709244 | 0.80 | SCN9A (0.66) | SCN9AMAPTHTTCYP3A4CYP2C19 | |
| SCHEMBL1709225 | 0.80 | SCN9A (0.66) | SCN9A | |
| SCHEMBL1286845 | 0.79 | SCN9A (0.66) | SCN9AALDH1A1KMT2ALMNA | |
| SCHEMBL1286785 | 0.79 | SCN9A (1.00) | SCN9AMAPTSMN1; SMN2HTTLMNA | |
| SCHEMBL1286821 | 0.76 | SCN9A (0.61) | SCN9AALDH1A1MAPTSMN1; SMN2MEN1 | |
| SCHEMBL1709230 | 0.76 | SCN9A (0.61) | SCN9AALDH1A1HTTMMP2MMP9 |
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 |