Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPEPPS | P55786 | 2/20 | 0.32 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.30 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.30 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.30 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.30 |
| ▸ | CTSS | P25774 | 1/20 | 0.30 |
| ▸ | CTSK | P43235 | 1/20 | 0.30 |
| ▸ | KLK7 | P49862 | 1/20 | 0.30 |
| ▸ | KLK5 | Q9Y337 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL23120243 | 1.00 | NPEPPS (0.32) | NPEPPSCHRNB2CHRNB4CHRNA3CHRNA4 | |
| SCHEMBL23137092 | 0.96 | KLK7 (0.32) | NPEPPSKLK7KLK5 | |
| SCHEMBL23120262 | 0.96 | NPEPPS (0.30) | NPEPPS | |
| SCHEMBL23120257 | 0.96 | NPEPPS (0.30) | NPEPPS | |
| SCHEMBL23120386 | 0.94 | — | — | |
| SCHEMBL23137075 | 0.92 | NPEPPS (0.30) | NPEPPS | |
| SCHEMBL23137015 | 0.92 | NPEPPS (0.30) | NPEPPS | |
| SCHEMBL23137086 | 0.91 | — | — | |
| SCHEMBL23120444 | 0.87 | NPEPPS (0.30) | NPEPPS | |
| SCHEMBL23120441 | 0.87 | NPEPPS (0.30) | NPEPPS |
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-2021053158-A1 | NOVEL HISTONE METHYLTRANSFERASE INHIBITORS | ALBERT-LUDWIGS-UNIVERSITÄT FREIBURG (DE) | 2021-03-25 | — | — | WO | disclosed |