Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 3/20 | 0.46 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.40 |
| ▸ | PDE4A | P27815 | 3/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.35 |
| ▸ | PDE8B | O95263 | 1/20 | 0.34 |
| ▸ | PI4KA | P42356 | 1/20 | 0.34 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.34 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.34 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 3/20 | 0.34 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.34 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.33 |
| ▸ | SHMT2 | P34897 | 1/20 | 0.33 |
| ▸ | NSD2 | O96028 | 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 | |
|---|---|---|---|---|
| SCHEMBL31391497 | 1.00 | PDE2A (0.46) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL30095656 | 0.83 | PDE10A (0.47) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL29174941 | 0.83 | PDE10A (0.47) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL30095840 | 0.82 | PDE2A (0.46) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL29174903 | 0.82 | PDE2A (0.46) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL4698941 | 0.77 | PDE2A (0.42) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL31391465 | 0.73 | PDE2A (0.42) | PDE2AMEN1KMT2AHRH1HRH4 | |
| SCHEMBL25746365 | 0.73 | PDE2A (0.42) | PDE2AMEN1KMT2AHRH1HRH4 | |
| SCHEMBL31391385 | 0.72 | PDE2A (0.38) | PDE2ACHRM3PDE4APDE4BPDE4C | |
| SCHEMBL31391527 | 0.68 | PDE2A (0.38) | PDE2AMEN1KMT2AHRH1HRH4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023118507-A2 | COMPOUNDS AND USE THEREOF AS HDAC6 INHIBITORS | AUGUSTINE THERAPEUTICS (BE) | 2023-06-29 | — | — | WO | disclosed |