Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | GPR6 | P46095 | 2/20 | 0.37 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.35 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.35 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.35 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.35 |
| ▸ | MTOR | P42345 | 1/20 | 0.35 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.35 |
| ▸ | TNIK | Q9UKE5 | 2/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | FGFR4 | P22455 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL19670392 | 0.91 | GRM5 (0.38) | BRAFGRM5GPR6PDK1PDK2 | |
| SCHEMBL19670233 | 0.88 | FAAH (0.39) | PDK1PDK2PDK3PDK4KCNH2 | |
| SCHEMBL19670471 | 0.87 | POLQ (0.35) | BRAFGSK3BDYRK1A | |
| SCHEMBL19365743 | 0.87 | THRB (0.40) | PDK1PDK2PDK3PDK4MTOR | |
| SCHEMBL16775992 | 0.86 | GRM5 (0.40) | BRAFGRM5GPR6MTORADORA2A | |
| SCHEMBL19365522 | 0.85 | KDM4E (0.39) | BRAFDYRK1A | |
| SCHEMBL17618490 | 0.85 | GPR6 (0.40) | BRAFGRM5GPR6KCNH2TNIK | |
| SCHEMBL19670515 | 0.84 | WNT3A (0.35) | MTORGSK3B | |
| SCHEMBL19670231 | 0.84 | USP30 (0.40) | GRM5PDK1PDK2PDK3PDK4 | |
| SCHEMBL19670420 | 0.83 | HDAC2 (0.42) | GPR6PDK1PDK2PDK3PDK4 |
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 |