Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 2/20 | 0.38 |
| ▸ | BRAF | P15056 | 1/20 | 0.38 |
| ▸ | GPR6 | P46095 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 3/20 | 0.34 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.34 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.34 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.34 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | MLNR | O43193 | 2/20 | 0.33 |
| ▸ | USP30 | Q70CQ3 | 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 | |
|---|---|---|---|---|
| SCHEMBL19365517 | 0.91 | BRAF (0.40) | GRM5BRAFGPR6MTORPDK1 | |
| SCHEMBL19670252 | 0.88 | THRB (0.38) | MTORPDK1PDK2PDK3PDK4 | |
| SCHEMBL19670258 | 0.87 | KCNH2 (0.37) | GRM5BRAFGPR6MTORPDK1 | |
| SCHEMBL19670241 | 0.85 | GRM5 (0.38) | GRM5MTORPDK1PDK2PDK3 | |
| SCHEMBL19670174 | 0.84 | HDAC2 (0.39) | GRM5MTORPDK1PDK2PDK3 | |
| SCHEMBL19670172 | 0.84 | ADORA2A (0.37) | MTORPDK1PDK2PDK3PDK4 | |
| SCHEMBL19670388 | 0.84 | CACNA1G (0.46) | BRAF | |
| SCHEMBL16775992 | 0.84 | GRM5 (0.40) | GRM5BRAFGPR6MTORADORA2A | |
| SCHEMBL17618490 | 0.83 | GPR6 (0.40) | GRM5BRAFGPR6USP30 | |
| SCHEMBL19670593 | 0.82 | JAK1 (0.38) | MTORPDK1PDK2PDK3PDK4 |
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 |