Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.38 |
| ▸ | ATR | Q13535 | 1/20 | 0.38 |
| ▸ | GSK3B | P49841 | 2/20 | 0.36 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.35 |
| ▸ | IGF1R | P08069 | 1/20 | 0.35 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | PORCN | Q9H237 | 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 | |
|---|---|---|---|---|
| SCHEMBL19364834 | 0.98 | ALDH1A1 (0.39) | ABL1ATRGSK3BDYRK1AALDH1A1 | |
| SCHEMBL19364828 | 0.91 | SLC6A9 (0.41) | ALDH1A1GRM5SLC6A9IGF1RSLC6A5 | |
| SCHEMBL19670340 | 0.90 | HDAC2 (0.38) | ABL1GSK3BDYRK1AHDAC2CYP3A4 | |
| SCHEMBL20633314 | 0.89 | ALDH1A1 (0.34) | ABL1ATRGSK3BDYRK1AALDH1A1 | |
| SCHEMBL19365794 | 0.89 | ATR (0.38) | ATRGSK3BALDH1A1GRM5 | |
| SCHEMBL19365471 | 0.88 | ATR (0.36) | ATRDYRK1AALDH1A1GRM5HDAC2 | |
| SCHEMBL19365309 | 0.88 | CNR2 (0.40) | ATRGSK3BALDH1A1GRM5HDAC2 | |
| SCHEMBL19670409 | 0.88 | PRMT5 (0.42) | ATRGRM5 | |
| SCHEMBL19365295 | 0.87 | GSK3B (0.39) | ATRGSK3BDYRK1AALDH1A1GRM5 | |
| SCHEMBL19365302 | 0.87 | GSK3B (0.39) | ATRGSK3BDYRK1AGRM5HDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| US-9765075-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-09-19 | — | — | US | disclosed |