Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 4/20 | 0.52 |
| ▸ | FAAH | O00519 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | DEGS1 | O15121 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | MMP3 | P08254 | 1/20 | 0.42 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1709209 | 0.88 | SMN1; SMN2 (0.53) | SCN9AFAAHALDH1A1DRD4TSHR | |
| SCHEMBL1709207 | 0.85 | SCN9A (0.54) | SCN9AALDH1A1DRD4KMT2AMMP3 | |
| SCHEMBL1709219 | 0.82 | SCN9A (0.74) | SCN9AALDH1A1DRD4KMT2AKDM4E | |
| SCHEMBL1709274 | 0.81 | ALDH1A1 (0.53) | SCN9AALDH1A1DRD4KMT2A | |
| SCHEMBL10071958 | 0.80 | DRD4 (0.67) | SCN9ADRD4 | |
| SCHEMBL1709263 | 0.79 | SCN9A (0.53) | SCN9AALDH1A1DRD4KMT2AMMP3 | |
| SCHEMBL10072168 | 0.77 | SCN9A (0.56) | SCN9AALDH1A1DRD4KMT2AKDM4E | |
| SCHEMBL1286815 | 0.77 | KMT2A (0.55) | SCN9ADRD4KMT2AMMP3HDAC8 | |
| SCHEMBL1709268 | 0.77 | SCN9A (0.46) | SCN9AALDH1A1DRD4KMT2A | |
| SCHEMBL1286845 | 0.77 | SCN9A (0.66) | SCN9AALDH1A1DRD4KMT2AMMP3 |
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 |