Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | NOS1 | P29475 | 1/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 4/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | MALT1 | Q9UDY8 | 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 | |
|---|---|---|---|---|
| SCHEMBL1474210 | 0.83 | — | — | |
| SCHEMBL25859205 | 0.82 | SLC6A4 (0.39) | SLC6A4NOS1PDK1PDK2PDK3 | |
| SCHEMBL7069634 | 0.82 | SLC6A4 (0.39) | SLC6A4NOS1PDK1PDK2PDK3 | |
| Bromide SCHEMBL31444218 | 0.80 | SLC6A4 (0.38) | SLC6A4NOS1PDK1PDK2PDK3 | |
| SCHEMBL5592281 | 0.80 | PDK1 (0.40) | SLC6A4NOS1PDK1PDK2PDK3 | |
| SCHEMBL24687708 | 0.80 | PDK1 (0.40) | SLC6A4NOS1PDK1PDK2PDK3 | |
| SCHEMBL7818389 | 0.80 | NOS1 (0.39) | SLC6A4NOS1PDK1PDK2PDK3 | |
| Hydrochloric Acid SCHEMBL30289765 | 0.80 | SLC6A4 (0.38) | SLC6A4NOS1PDK1PDK2PDK3 | |
| SCHEMBL19703278 | 0.79 | NOS1 (0.37) | SLC6A4NOS1PDK1PDK2PDK3 | |
| SCHEMBL21369194 | 0.79 | — | — |
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-2007006714-A1 | CYSTEINE PROTEASE INHIBITORS | MEDIVIR AB (SE) | 2007-01-18 | — | — | WO | claimed |