Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMYD3 | Q9H7B4 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 10/20 | 0.35 |
| ▸ | CA2 | P00918 | 10/20 | 0.35 |
| ▸ | CA9 | Q16790 | 8/20 | 0.35 |
| ▸ | CA12 | O43570 | 7/20 | 0.35 |
| ▸ | PPM1B | O75688 | 1/20 | 0.33 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.33 |
| ▸ | PPP1CC | P36873 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.32 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9753080 | 0.99 | SMYD3 (0.36) | SMYD3CA1CA2CA9CA12 | |
| Hydrochloric Acid SCHEMBL9752801 | 0.89 | SMYD3 (0.37) | SMYD3CA1CA2CA9CA12 | |
| SCHEMBL6942075 | 0.87 | SMYD3 (0.40) | SMYD3CA1CA2CA9CA12 | |
| SCHEMBL6942077 | 0.87 | SMYD3 (0.40) | SMYD3CA1CA2CA9CA12 | |
| Hydrochloric Acid SCHEMBL28748271 | 0.86 | SMYD3 (0.39) | SMYD3CA1CA2CA9CA12 | |
| SCHEMBL9753431 | 0.74 | ALDH1A1 (0.43) | CA1CA2CA9CA12ALDH1A1 | |
| SCHEMBL9753446 | 0.74 | HSD17B10 (0.45) | ALDH1A1POLBL3MBTL1TSHR | |
| Hydrochloric Acid SCHEMBL9752856 | 0.73 | PKM (0.44) | CA1CA2CA9CA12ALDH1A1 | |
| SCHEMBL1848605 | 0.72 | SMYD3 (0.41) | SMYD3CA1CA2CA9CA12 | |
| SCHEMBL13826647 | 0.72 | SMYD3 (0.41) | SMYD3CA1CA2CA9CA12 |
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-1991007378-A1 | CYCLOALKYL-SUBSTITUTED GLUTARAMIDE DIURETIC AGENTS | PFIZER LIMITED (GB) | 1991-05-30 | — | — | WO | disclosed |