Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIK1 | P39086 | 1/20 | 0.47 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | GRM2 | Q14416 | 2/20 | 0.43 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL14145254 | 1.00 | GRIK1 (0.47) | GRIK1TRPA1SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL14145666 | 0.90 | GRIK1 (0.43) | GRIK1TRPA1SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL14145246 | 0.88 | GRIK1 (0.44) | GRIK1TRPA1SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL14201435 | 0.84 | TRPA1 (0.49) | GRIK1TRPA1SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL13953256 | 0.83 | ALOX5 (0.48) | TDP1PPARAALOX5 | |
| SCHEMBL14201498 | 0.81 | GRIK1 (0.50) | GRIK1TRPA1SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL14201434 | 0.81 | GRIK1 (0.50) | GRIK1TRPA1SMN1; SMN2HDAC3HDAC4 | |
| SCHEMBL14145649 | 0.80 | ALDH1A1 (0.42) | TRPA1SMN1; SMN2MMP2 | |
| SCHEMBL14259474 | 0.78 | GRIK1 (0.49) | GRIK1TRPA1MMP2MMP3 | |
| SCHEMBL14201480 | 0.78 | SMN1; SMN2 (0.42) | TRPA1SMN1; SMN2GRM2GRM3HIF1A |
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-2008083280-A1 | COMPOUNDS AND METHODS OF TREATING INSULIN RESISTANCE AND CARDIOMYOPATHY | TRANSITION THERAPEUTICS INC. (CA) | 2008-07-10 | — | — | WO | disclosed |