Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 4/20 | 0.44 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.39 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.39 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4551397 | 0.89 | HTT (0.42) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL5967919 | 0.79 | SLC1A3 (0.39) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL10562396 | 0.79 | SLC1A3 (0.39) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL4552159 | 0.77 | HTT (0.41) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL7976426 | 0.76 | TRPA1 (0.42) | CYP1A2CYP2D6MAPK1CYP3A4PSMB5 | |
| SCHEMBL12050573 | 0.76 | MEN1 (0.39) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL7451566 | 0.76 | HTT (0.58) | HTTKMT2AMAPK1CA1CA2 | |
| SCHEMBL10565001 | 0.75 | HTT (0.38) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL5764457 | 0.75 | HTT (0.41) | HTTSLC1A3SLC1A2SLC1A1MEN1 | |
| SCHEMBL9701036 | 0.75 | HTT (0.44) | HTTMEN1KMT2AMAPK1CYP3A4 |
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 |