Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | ADAM17 | P78536 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | BCHE | P06276 | 1/20 | 0.37 |
| ▸ | REN | P00797 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7424741 | 1.00 | HTT (0.46) | HTTPOLBADAM17GAABCHE | |
| SCHEMBL7353051 | 0.93 | ADAM17 (0.44) | HTTPOLBADAM17GAA | |
| SCHEMBL7353045 | 0.93 | ADAM17 (0.44) | HTTPOLBADAM17GAA | |
| SCHEMBL7352170 | 0.90 | GAA (0.39) | HTTPOLBADAM17GAAREN | |
| SCHEMBL7352165 | 0.90 | GAA (0.39) | HTTPOLBADAM17GAAREN | |
| SCHEMBL8897311 | 0.83 | REN (0.38) | BCHEREN | |
| SCHEMBL8897322 | 0.83 | REN (0.38) | BCHEREN | |
| SCHEMBL8897548 | 0.82 | BACE1 (0.33) | HTTADAM17REN | |
| SCHEMBL7360787 | 0.81 | HTT (0.44) | HTTPOLBADAM17GAABCHE | |
| SCHEMBL7360777 | 0.81 | HTT (0.44) | HTTPOLBADAM17GAABCHE |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5614522-A | SULFONAMIDE AND UREA-CONTAINING HYDROXYETHYLAMINE COMPOUNDS | G.D. SEARLE & CO. (US) | 1997-03-25 | — | — | US | disclosed |
| EP-0558673-A1 | RETROVIRAL PROTEASE INHIBITORS. | MONSANTO CO (US) | 1993-09-08 | — | — | EP | disclosed |
| WO-1992008699-A1 | RETROVIRAL PROTEASE INHIBITORS | MONSANTO COMPANY (US) | 1992-05-29 | — | — | WO | disclosed |