Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 14/20 | 0.34 |
| ▸ | PPARA | Q07869 | 12/20 | 0.34 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.33 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.32 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.32 |
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 SCHEMBL11179543 | 0.83 | PTGS1 (0.35) | PPARGPPARAPSMB5SLC6A2TAAR1 | |
| Hydrochloric Acid SCHEMBL11139244 | 0.81 | KDM4E (0.43) | PPARGPPARASLC6A2TAAR1MAOA | |
| Hydrochloric Acid SCHEMBL11659853 | 0.74 | MEN1 (0.43) | PPARGPPARASIGMAR1 | |
| Hydrochloric Acid SCHEMBL2524640 | 0.72 | SMN1; SMN2 (0.51) | PPARGPPARASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL25349713 | 0.72 | GABRA1 (0.35) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL6662799 | 0.71 | KDM4E (0.36) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| SCHEMBL5360957 | 0.69 | GABRA1 (0.33) | SLC6A2TAAR1MAOASLC6A4SLC6A3 | |
| Hydrochloric Acid SCHEMBL56683 | 0.68 | KDM4E (0.33) | MAOA | |
| Water SCHEMBL9229151 | 0.67 | KDM4E (0.33) | MAOA | |
| SCHEMBL5944539 | 0.63 | KDM4E (0.56) | SLC6A2TAAR1MAOASLC6A4SLC6A3 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0520160-A1 | Process for antimicrobial treatment of polyurethane | BOC HEALTH CARE, Inc. (US) | 1992-12-30 | — | — | EP | claimed |
| EP-0520160-A1 | Process for antimicrobial treatment of polyurethane | BOC HEALTH CARE, Inc. (US) | 1992-12-30 | — | — | EP | disclosed |