Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP1 | P29466 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.32 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.32 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.32 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.30 |
| ▸ | CSNK2A1 | P68400 | 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 | |
|---|---|---|---|---|
| SCHEMBL8988692 | 0.97 | CASP1 (0.32) | CASP1HRH3HDAC1PTPN1 | |
| SCHEMBL8988752 | 0.94 | ITGB3 (0.35) | CASP1CSNK2A2CSNK2A1 | |
| Hydrochloric Acid SCHEMBL8988635 | 0.93 | ITGB3 (0.34) | CASP1CSNK2A2CSNK2A1 | |
| SCHEMBL8988616 | 0.91 | CASP1 (0.35) | CASP1 | |
| SCHEMBL8988621 | 0.91 | CASP1 (0.32) | CASP1 | |
| SCHEMBL8988515 | 0.91 | HRH3 (0.36) | HRH3HDAC1PTPN1 | |
| SCHEMBL9564737 | 0.90 | HRH3 (0.34) | HRH3HDAC1PTPN1 | |
| SCHEMBL8988601 | 0.89 | ALDH1A1 (0.30) | — | |
| SCHEMBL9564740 | 0.88 | FKBP1A (0.36) | CASP1 | |
| SCHEMBL9564728 | 0.88 | HRH3 (0.33) | HRH3HDAC1PTPN1 |
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-0567968-A1 | Cyclic imino derivatives, medicaments containing these compounds and processes for the production thereof | Dr. Karl Thomae GmbH (DE) | 1993-11-03 | — | — | EP | disclosed |