Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.37 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.37 |
| ▸ | ABL1 | P00519 | 1/20 | 0.37 |
| ▸ | ATR | Q13535 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19365583 | 0.98 | ABL1 (0.38) | ALDH1A1SLC6A9SLC6A5ABL1ATR | |
| SCHEMBL20633314 | 0.91 | ALDH1A1 (0.34) | ALDH1A1SLC6A9SLC6A5ABL1ATR | |
| SCHEMBL19670340 | 0.90 | HDAC2 (0.38) | ABL1GSK3BDYRK1AHDAC2 | |
| SCHEMBL19365471 | 0.90 | ATR (0.36) | ALDH1A1ATRPOLBDYRK1AHDAC2 | |
| SCHEMBL19670409 | 0.90 | PRMT5 (0.42) | ATR | |
| SCHEMBL19365309 | 0.90 | CNR2 (0.40) | ALDH1A1ATRGSK3BHDAC2 | |
| SCHEMBL19364828 | 0.89 | SLC6A9 (0.41) | ALDH1A1SLC6A9SLC6A5NPC1 | |
| SCHEMBL19365441 | 0.88 | ATR (0.48) | ABL1ATRNPC1POLBHDAC2 | |
| SCHEMBL19706240 | 0.88 | WNT1 (0.40) | ALDH1A1ATRNPC1DYRK1AHDAC2 | |
| SCHEMBL19670535 | 0.87 | GSK3B (0.38) | ALDH1A1ATRGSK3BDYRK1AHDAC2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |
| US-9765075-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-09-19 | — | — | US | disclosed |