Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1B | Q00975 | 1/20 | 0.45 |
| ▸ | CYSLTR2 | Q9NS75 | 3/20 | 0.45 |
| ▸ | CYSLTR1 | Q9Y271 | 3/20 | 0.45 |
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
| ▸ | PPARG | P37231 | 1/20 | 0.43 |
| ▸ | PPARA | Q07869 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | PLA2G4B | P0C869 | 2/20 | 0.41 |
| ▸ | ACACB | O00763 | 1/20 | 0.41 |
| ▸ | ACACA | Q13085 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL3026700 | 1.00 | CACNA1B (0.45) | CACNA1BCYSLTR2CYSLTR1PTGESALOX5 | |
| SCHEMBL16766527 | 0.84 | PTGES (0.48) | CACNA1BCYSLTR2CYSLTR1PTGESALOX5 | |
| SCHEMBL21656313 | 0.84 | L3MBTL1 (0.50) | KDM4E | |
| SCHEMBL30854869 | 0.82 | KMT2A (0.55) | ALOX5ACACBSMN1; SMN2SMPD1 | |
| SCHEMBL3025733 | 0.82 | KMT2A (0.55) | ALOX5ACACBSMN1; SMN2SMPD1 | |
| SCHEMBL3032716 | 0.80 | CACNA1B (0.68) | CACNA1B | |
| SCHEMBL3016179 | 0.79 | CYP2D6 (0.57) | CACNA1BCYSLTR2CYSLTR1PTGESALOX5 | |
| SCHEMBL3022697 | 0.78 | CACNA1B (0.56) | CACNA1BCYSLTR2CYSLTR1KDM4EALDH1A1 | |
| SCHEMBL21656196 | 0.78 | ROCK2 (0.44) | KDM4E | |
| SCHEMBL30854880 | 0.78 | ROCK2 (0.42) | KDM4ELMNATSHR |
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-117865843-A | Nicotinamide derivatives for the preparation of sodium and/or calcium channel modulators | 赛诺金医药科技(无锡)有限公司 | 2024-04-12 | — | — | CN | disclosed |