Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 2/20 | 0.35 |
| ▸ | ROCK1 | Q13464 | 5/20 | 0.35 |
| ▸ | CDC42BPB | Q9Y5S2 | 5/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | PBK | Q96KB5 | 2/20 | 0.34 |
| ▸ | CDC42BPA | Q5VT25 | 1/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.34 |
| ▸ | SCD | O00767 | 1/20 | 0.33 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.33 |
| ▸ | HCRTR2 | O43614 | 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 | |
|---|---|---|---|---|
| SCHEMBL16754481 | 1.00 | USP30 (0.39) | USP30MAP4K4GRM5ROCK1CDC42BPB | |
| SCHEMBL16754650 | 0.93 | USP30 (0.40) | USP30MAP4K4CYP11B2PDE10AHRH3 | |
| SCHEMBL16239247 | 0.93 | USP30 (0.40) | USP30MAP4K4CYP11B2PDE10AHRH3 | |
| SCHEMBL17768048 | 0.93 | USP30 (0.40) | USP30MAP4K4CYP11B2PDE10AHRH3 | |
| SCHEMBL17769541 | 0.84 | USP30 (0.36) | USP30GRM5ROCK1CDC42BPBROCK2 | |
| SCHEMBL17778410 | 0.84 | ROCK2 (0.35) | ROCK1CDC42BPBROCK2PBKCDC42BPA | |
| SCHEMBL16754542 | 0.84 | MAP4K4 (0.39) | MAP4K4MAPK1 | |
| SCHEMBL16754721 | 0.84 | MAP4K4 (0.39) | MAP4K4MAPK1 | |
| SCHEMBL17769518 | 0.83 | GRM5 (0.39) | USP30GRM5ROCK1CDC42BPBROCK2 | |
| SCHEMBL17769292 | 0.83 | MAPK1 (0.37) | USP30CYP11B2PDE10AMAPK1HRH3 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2016079711-A1 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) | 2016-05-26 | — | — | WO | disclosed |
| WO-2016081692-A2 | SUBSTITUTED BRIDGED UREA ANALOGS AS SIRTUIN MODULATORS | GLAXOSMITHKLINE LLC (US) | 2016-05-26 | — | — | WO | disclosed |