Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.54 |
| ▸ | CA2 | P00918 | 3/20 | 0.54 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.54 |
| ▸ | PDE4B | Q07343 | 13/20 | 0.47 |
| ▸ | PDE4A | P27815 | 11/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 11/20 | 0.47 |
| ▸ | PDE4D | Q08499 | 11/20 | 0.47 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | PDE1A | P54750 | 1/20 | 0.43 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.43 |
| ▸ | PDE7A | Q13946 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA9 | Q16790 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL15981495 | 0.84 | CA1 (0.54) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL500368 | 0.81 | CA1 (0.59) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL19605426 | 0.81 | CA1 (0.51) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL15985528 | 0.80 | CA1 (0.50) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL1233159 | 0.80 | CA1 (0.50) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL19605204 | 0.80 | CA1 (0.57) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL12475434 | 0.80 | CA1 (0.57) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL14363857 | 0.80 | CA1 (0.57) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL15981494 | 0.77 | CA1 (0.47) | CA1CA2PDE3APDE4BPDE4A | |
| SCHEMBL12383675 | 0.77 | CA1 (0.47) | CA1CA2PDE3APDE4BPDE4A |
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-2022115417-A1 | SULFONYL UREA NLRP3 INFLAMMASOME INHIBITORS | VenatoRx Pharmaceuticals, Inc. (US) | 2022-06-02 | — | — | WO | disclosed |