Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.37 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | ACACA | Q13085 | 1/20 | 0.34 |
| ▸ | PPARA | Q07869 | 4/20 | 0.33 |
| ▸ | PPARD | Q03181 | 3/20 | 0.33 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL3718911 | 0.82 | HSP90AA1 (0.37) | ACACBHSP90AA1HSP90AB1PTPN1CA1 | |
| SCHEMBL1221847 | 0.80 | PTPN1 (0.53) | ACACBHSP90AA1HSP90AB1PTPN1CA1 | |
| SCHEMBL3715985 | 0.77 | PDK2 (0.36) | ACACBCA1CA2CA7CA9 | |
| SCHEMBL3715982 | 0.73 | ACACB (0.36) | ACACBCA1CA2CA7CA9 | |
| SCHEMBL1221859 | 0.71 | PTPN1 (0.46) | HSP90AA1HSP90AB1PTPN1MEN1KMT2A | |
| SCHEMBL3714563 | 0.71 | SCN9A (0.37) | HSP90AA1HSP90AB1PPARAPPARDMAPT | |
| SCHEMBL410531 | 0.68 | HSP90AA1 (0.36) | HSP90AA1HSP90AB1MEN1KMT2AMAPT | |
| SCHEMBL4055657 | 0.68 | LIMK1 (0.38) | KMT2ALIMK1ALDH1A1NPSR1 | |
| SCHEMBL3219126 | 0.68 | PDK2 (0.42) | ACACBMEN1KMT2APDK2ACACA | |
| SCHEMBL1545046 | 0.68 | HSP90AA1 (0.40) | HSP90AA1HSP90AB1PTPN1MEN1KMT2A |
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-2010081149-A1 | ANTI-VIRAL COMPOUNDS, COMPOSITIONS, AND METHODS OF USE | GLAXOSMITHKLINE LLC (US) | 2010-07-15 | — | — | WO | disclosed |