Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATR | Q13535 | 1/20 | 0.42 |
| ▸ | PRKCA | P17252 | 1/20 | 0.42 |
| ▸ | PRKCQ | Q04759 | 1/20 | 0.42 |
| ▸ | AKT1 | P31749 | 5/20 | 0.38 |
| ▸ | SYK | P43405 | 2/20 | 0.37 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.37 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.37 |
| ▸ | JAK2 | O60674 | 2/20 | 0.37 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.36 |
| ▸ | CASR | P41180 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 1/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 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 | |
|---|---|---|---|---|
| SCHEMBL19670525 | 0.91 | ATR (0.45) | ATRPRKCAPRKCQAKT1SYK | |
| SCHEMBL19670395 | 0.87 | ATR (0.45) | ATRPRKCAPRKCQAKT1SYK | |
| SCHEMBL19670413 | 0.87 | ATR (0.43) | ATRPRKCAPRKCQAKT1SYK | |
| SCHEMBL19670643 | 0.86 | ATR (0.47) | ATRPRKCAPRKCQSYKMAPK8 | |
| SCHEMBL19670248 | 0.83 | ATR (0.41) | ATRPRKCAPRKCQAKT1SYK | |
| SCHEMBL19365521 | 0.83 | POLB (0.39) | — | |
| SCHEMBL19670400 | 0.82 | ATR (0.45) | ATRPRKCAPRKCQAKT1SYK | |
| SCHEMBL19365567 | 0.82 | HDAC1 (0.43) | ATR | |
| SCHEMBL19365747 | 0.82 | MCHR1 (0.41) | ATR | |
| SCHEMBL19365325 | 0.78 | FAAH (0.36) | — |
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-9834558-B2 | Substituted bridged urea analogs as sirtuin modulators | GLAXOSMITHKLINE LLC (US) | 2017-12-05 | — | — | US | disclosed |