Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 12/20 | 0.40 |
| ▸ | CHRNB4 | P30926 | 12/20 | 0.40 |
| ▸ | CHRNA3 | P32297 | 12/20 | 0.40 |
| ▸ | CHRNA4 | P43681 | 12/20 | 0.40 |
| ▸ | SSTR2 | P30874 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 1/20 | 0.35 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.35 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.35 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL17796709 | 0.82 | CCR6 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23707244 | 0.82 | CCR6 (0.42) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL30811747 | 0.80 | CHRNB2 (0.61) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL27883238 | 0.78 | NOS3 (0.33) | CHRNB2CHRNB4CHRNA3CHRNA4SSTR2 | |
| SCHEMBL30811741 | 0.76 | CHRNA3 (0.47) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23515037 | 0.76 | GAA (0.45) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL17796820 | 0.76 | SMPD3 (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL17796769 | 0.76 | SMPD3 (0.43) | CHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23770737 | 0.74 | CHRNB2 (0.47) | CHRNB2CHRNA4 | |
| SCHEMBL24534142 | 0.74 | CHRNB2 (0.47) | CHRNB2CHRNA4 |
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-2022128850-A1 | NOVEL ISOQUINOLINE DERIVATIVES AND PHARMACEUTICAL COPOSITIONS THEREOF FOR THE TREATMENT OF DISEASES | GALAPAGOS NV (BE) | 2022-06-23 | — | — | WO | disclosed |