Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 7/20 | 0.39 |
| ▸ | PKM | P14618 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL1102133 | 0.90 | KMO (0.45) | SCN9A | |
| SCHEMBL1102019 | 0.87 | SCN9A (0.46) | SCN9A | |
| SCHEMBL13629586 | 0.87 | SCN9A (0.47) | LMNASMN1; SMN2MEN1ALDH1A1KMT2A | |
| SCHEMBL1102059 | 0.87 | LMNA (0.41) | LMNATSHRSMN1; SMN2SCN9APKM | |
| SCHEMBL13403975 | 0.84 | MEN1 (0.44) | LMNATSHRSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL1102109 | 0.84 | SCN9A (0.45) | SCN9A | |
| SCHEMBL10200628 | 0.84 | MAPT (0.42) | SMN1; SMN2MEN1ALDH1A1KMT2AMAPT | |
| SCHEMBL1102021 | 0.79 | PKM (0.42) | LMNATSHRSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL1102120 | 0.79 | SCN9A (0.47) | LMNATSHRSMN1; SMN2MEN1ALDH1A1 | |
| SCHEMBL1102061 | 0.79 | PKM (0.42) | LMNATSHRSMN1; SMN2MEN1ALDH1A1 |
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-7615563-B2 | Compositions useful as inhibitors of voltage-gated sodium channels | VERTEX PHARMACEUTICALS INCORPORATED | 2009-11-10 | — | — | US | disclosed |