Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MTR | Q99707 | 1/20 | 0.35 |
| ▸ | SCN1A | P35498 | 12/20 | 0.34 |
| ▸ | SCN5A | Q14524 | 12/20 | 0.34 |
| ▸ | SCN9A | Q15858 | 12/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.34 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.34 |
| ▸ | PARP1 | P09874 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8479247 | 0.95 | SCN1A (0.37) | MTRSCN1ASCN5ASCN9AAOC3 | |
| SCHEMBL8664250 | 0.94 | SCN1A (0.34) | MTRSCN1ASCN5ASCN9AKDM5A | |
| SCHEMBL8502235 | 0.94 | AOC3 (0.32) | MTRSCN1ASCN5ASCN9AKDM5A | |
| SCHEMBL8666702 | 0.93 | SCN1A (0.33) | MTRSCN1ASCN5ASCN9AKDM5A | |
| SCHEMBL8487928 | 0.90 | SCN1A (0.36) | MTRSCN1ASCN5ASCN9AAOC3 | |
| SCHEMBL8479611 | 0.88 | SCN1A (0.35) | MTRSCN1ASCN5ASCN9AAOC3 | |
| SCHEMBL8503706 | 0.88 | SCN1A (0.31) | MTRSCN1ASCN5ASCN9AAOC3 | |
| SCHEMBL8503796 | 0.87 | AOC3 (0.30) | SCN1ASCN5ASCN9AAOC3 | |
| SCHEMBL8485599 | 0.81 | MTR (0.38) | MTRSCN1ASCN5ASCN9AKDM5A | |
| SCHEMBL8668077 | 0.81 | OPRK1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5827875-A | PYRROLIDINE DERIVATIVES; ANTIATHEROSCLEROSIS AGENTS | BRISTOL-MYERS SQUIBB COMPANY (US) | 1998-10-27 | — | — | US | disclosed |