Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 3/20 | 0.36 |
| ▸ | ACACB | O00763 | 2/20 | 0.36 |
| ▸ | ACACA | Q13085 | 1/20 | 0.33 |
| ▸ | SDHB | P21912 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA7 | P43166 | 3/20 | 0.33 |
| ▸ | CA9 | Q16790 | 3/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.33 |
| ▸ | CA12 | O43570 | 2/20 | 0.33 |
| ▸ | CA6 | P23280 | 1/20 | 0.33 |
| ▸ | CA5A | P35218 | 1/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | THRA | P10827 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 4/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL3227658 | 0.84 | KCNH2 (0.43) | MAPTKDM4EMEN1KMT2AKCNH2 | |
| SCHEMBL1437847 | 0.84 | PDK2 (0.41) | PDK2ACACBACACATHRATHRB | |
| SCHEMBL3718958 | 0.82 | ACACB (0.39) | PDK2ACACBACACATHRATHRB | |
| SCHEMBL1436664 | 0.81 | MAPT (0.43) | PDK2ACACBACACATHRATHRB | |
| SCHEMBL3715982 | 0.80 | ACACB (0.36) | PDK2ACACBACACASDHBCA1 | |
| SCHEMBL1509457 | 0.78 | PDK2 (0.38) | PDK2ACACBACACATHRATHRB | |
| SCHEMBL1509418 | 0.77 | THRA (0.36) | PDK2ACACBACACATHRATHRB | |
| SCHEMBL1509420 | 0.77 | SMN1; SMN2 (0.36) | PDK2ACACBTHRATHRBMAPT | |
| SCHEMBL3717880 | 0.77 | ACACB (0.38) | PDK2ACACBACACACA1CA2 | |
| SCHEMBL1509422 | 0.77 | SMN1; SMN2 (0.37) | PDK2ACACBTHRATHRBMAPT |
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 |