Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYSLTR1 | Q9Y271 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 9/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 5/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL24136413 | 0.76 | HRH3 (0.45) | CYSLTR1 | |
| SCHEMBL22369027 | 0.74 | MAOB (0.44) | CYSLTR1 | |
| SCHEMBL20834081 | 0.74 | CYSLTR1 (0.49) | CYSLTR1 | |
| SCHEMBL22457039 | 0.74 | CYSLTR1 (0.44) | CYSLTR1 | |
| SCHEMBL23446721 | 0.74 | CYSLTR1 (0.51) | CYSLTR1 | |
| SCHEMBL25111145 | 0.71 | ITGB3 (0.51) | CYSLTR1PTPN1EGFR | |
| SCHEMBL458062 | 0.71 | GSK3B (0.59) | GSK3BPTPN1 | |
| SCHEMBL20834271 | 0.70 | FFAR4 (0.49) | CYSLTR1 | |
| SCHEMBL41220 | 0.70 | NR4A1 (0.70) | GSK3BPTPN1EGFR | |
| SCHEMBL9425358 | 0.69 | PTPN1 (0.53) | GSK3BPTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3683207-A1 | N-ALKYLARYL-5-OXYARYL-OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE ALLOSTERIC MODULATORS OF NR2B | Cadent Therapeutics, Inc. (US) | 2020-07-22 | — | — | EP | disclosed |