Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | JAK3 | P52333 | 1/20 | 0.34 |
| ▸ | MELK | Q14680 | 1/20 | 0.33 |
| ▸ | PGK1 | P00558 | 1/20 | 0.33 |
| ▸ | AKT1 | P31749 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.32 |
| ▸ | RPS6KA1 | Q15418 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7576503 | 0.71 | KDM4E (0.34) | ALDH1A1HTTGRM5JAK3 | |
| SCHEMBL8560673 | 0.71 | JAK3 (0.34) | JAK3 | |
| SCHEMBL739723 | 0.70 | ALDH1A1 (0.43) | ALDH1A1GAAHTTGRM5AKT1 | |
| Alcohol SCHEMBL28121239 | 0.69 | JAK3 (0.39) | ALDH1A1JAK3 | |
| SCHEMBL15211469 | 0.67 | ALDH1A1 (0.42) | ALDH1A1JAK3 | |
| SCHEMBL17522878 | 0.67 | ALDH1A1 (0.36) | ALDH1A1GAAHTTGRM5MELK | |
| SCHEMBL4281580 | 0.65 | CYP2A6 (0.66) | ALDH1A1GRM5MELK | |
| Methyl Alcohol SCHEMBL16458351 | 0.65 | JAK3 (0.42) | ALDH1A1GRM5JAK3 | |
| SCHEMBL9088542 | 0.64 | ALDH1A1 (0.36) | ALDH1A1GAAHTTMELKPGK1 | |
| SCHEMBL27712286 | 0.64 | NOS2 (0.39) | ALDH1A1GAAHTTMELK |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101111499-B | Substituted ethynyl gold-nitrogen-containing heterocyclic carbene complex and organic electroluminescent device using the same | UBE INDUSTRIES | 2012-05-23 | — | — | CN | disclosed |
| CN-101111499-A | Substituted ethynyl gold-nitrogenated heterocyclic carbene complex and organic electroluminescent device using same | UBE INDUSTRIES (JP) | 2008-01-23 | — | — | CN | disclosed |