Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CNR1 | P21554 | 2/20 | 0.30 |
| ▸ | CNR2 | P34972 | 2/20 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6988641 | 0.99 | ACE2 (0.34) | ACE2ESR1CNR1CNR2 | |
| Hydrochloric Acid SCHEMBL6992620 | 0.85 | ACE2 (0.32) | ACE2ESR1 | |
| Hydrochloric Acid SCHEMBL6999219 | 0.83 | ESR1 (0.33) | ACE2ESR1 | |
| Hydrochloric Acid SCHEMBL8119304 | 0.82 | GAA (0.35) | — | |
| Hydrochloric Acid SCHEMBL8118427 | 0.81 | ESR1 (0.31) | ESR1 | |
| SCHEMBL7988325 | 0.80 | ALDH1A1 (0.36) | ACE2 | |
| SCHEMBL6996954 | 0.80 | ACE2 (0.32) | ACE2 | |
| Hydrochloric Acid SCHEMBL6991848 | 0.79 | ACE2 (0.31) | ACE2 | |
| SCHEMBL7708334 | 0.78 | ALDH1A1 (0.32) | ACE2 | |
| SCHEMBL7003121 | 0.76 | KCNH2 (0.46) | — |
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-1015437-B1 | BENZOXAZINE AND BENZOTHIAZINE DERIVATIVES AND THEIR USE IN PHARMACEUTICALS | SCHERING AG (DE) | 2003-12-03 | — | — | EP | claimed |