Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
| ▸ | GRIK1 | P39086 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | PPARA | Q07869 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.36 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7503698 | 0.81 | MEN1 (0.43) | SIGMAR1 | |
| SCHEMBL9369737 | 0.81 | GRIK1 (0.40) | SIGMAR1GRIK1 | |
| SCHEMBL9708802 | 0.80 | TRPA1 (0.41) | SIGMAR1MAPK1CYP3A4TRPA1SLC6A3 | |
| SCHEMBL7300749 | 0.80 | TRPA1 (0.41) | SIGMAR1MAPK1CYP3A4TRPA1SLC6A3 | |
| SCHEMBL9708851 | 0.80 | TRPA1 (0.41) | SIGMAR1MAPK1CYP3A4TRPA1SLC6A3 | |
| SCHEMBL7277789 | 0.80 | TRPA1 (0.41) | SIGMAR1MAPK1CYP3A4TRPA1SLC6A3 | |
| SCHEMBL7451566 | 0.74 | HTT (0.58) | MAPK1 | |
| SCHEMBL9701036 | 0.73 | HTT (0.44) | MAPK1CYP3A4 | |
| SCHEMBL11960028 | 0.72 | HSD17B2 (0.42) | CYP3A4SLC6A3SMN1; SMN2 | |
| SCHEMBL11960074 | 0.72 | HSD17B2 (0.42) | CYP3A4SLC6A3SMN1; SMN2 |
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-1992000948-A1 | INHIBITORS OF RETROVIRAL PROTEASES | SMITHKLINE BEECHAM CORPORATION (US) | 1992-01-23 | — | — | WO | disclosed |