Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | ESR1 | P03372 | 1/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | PDE9A | O76083 | 16/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.45 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22072396 | 0.92 | LMNA (0.57) | LMNAESR1L3MBTL1PDE9ASMN1; SMN2 | |
| SCHEMBL22072398 | 0.88 | PDE9A (0.61) | LMNAESR1L3MBTL1PDE9APDE1C | |
| SCHEMBL22072367 | 0.87 | PDE9A (0.46) | PDE9APDE1CPDE1B | |
| SCHEMBL22072364 | 0.86 | PDE9A (0.47) | ESR1PDE9APDE1CPDE1BALDH1A1 | |
| SCHEMBL22072366 | 0.85 | CYP1A2 (0.59) | L3MBTL1PDE9ASMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL22071807 | 0.84 | PDE9A (0.56) | LMNAESR1L3MBTL1PDE9A | |
| SCHEMBL22042934 | 0.82 | SMN1; SMN2 (0.47) | LMNASMN1; SMN2ALDH1A1TSHR | |
| SCHEMBL22042861 | 0.78 | PDE9A (0.50) | PDE9APDE1CPDE1B | |
| SCHEMBL22042836 | 0.77 | ALDH1A1 (0.50) | ESR1PDE9APDE1CPDE1BALDH1A1 | |
| SCHEMBL7879153 | 0.77 | PDE9A (0.74) | PDE9APDE1C |
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-2020116972-A1 | COMPOUNDS HAVING PDE9A INHIBITORY ACTIVITY, AND PHARMACEUTICAL USES THEREOF | 한국화학연구원 | 2020-06-11 | — | — | WO | disclosed |