Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | GPR6 | P46095 | 2/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.36 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.36 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.36 |
| ▸ | MTOR | P42345 | 1/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.35 |
| ▸ | TEK | Q02763 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.35 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19670423 | 0.86 | TRPV3 (0.38) | BRD4TEKALDH1A1KDM4EHTT | |
| SCHEMBL16775942 | 0.86 | HDAC2 (0.37) | HDAC2GPR6MTORWDR5ROCK2 | |
| SCHEMBL19365743 | 0.86 | THRB (0.40) | HDAC2BRD4PDK1PDK2PDK3 | |
| SCHEMBL19670236 | 0.85 | DHODH (0.40) | TEKROCK2 | |
| SCHEMBL17618453 | 0.84 | GPR6 (0.39) | HDAC2GPR6ALDH1A1USP30THRB | |
| SCHEMBL19670420 | 0.84 | HDAC2 (0.42) | HDAC2GPR6BRD4PDK1PDK2 | |
| SCHEMBL19670220 | 0.83 | ROCK2 (0.34) | BRD4MTORROCK2 | |
| SCHEMBL19670231 | 0.83 | USP30 (0.40) | BRD4PDK1PDK2PDK3PDK4 | |
| SCHEMBL19670377 | 0.82 | CRACR2A (0.35) | HDAC2BRD4MTORCCNA2CDK2 | |
| SCHEMBL19670379 | 0.82 | PRMT5 (0.37) | BRD4ROCK2 |
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 |