Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | DRD2 | P14416 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.38 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.38 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.38 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.38 |
| ▸ | DRD1 | P21728 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7438495 | 0.95 | KDM4E (0.43) | KDM4EALDH1A1MAPK1ACHECHRM1 | |
| SCHEMBL7439679 | 0.88 | KDM4E (0.46) | KDM4EALDH1A1MAPK1ACHEHTR1A | |
| SCHEMBL7437843 | 0.87 | KDM4E (0.44) | KDM4EALDH1A1MAPK1ACHECHRM1 | |
| SCHEMBL7429940 | 0.86 | PAX8 (0.49) | KDM4EALDH1A1MAPK1ACHECHRM1 | |
| Hydrochloric Acid SCHEMBL10459287 | 0.85 | PAX8 (0.48) | KDM4EALDH1A1MAPK1ACHECHRM1 | |
| SCHEMBL10459160 | 0.84 | ABCB11 (0.53) | KDM4EALDH1A1ACHECHRM1HTR1A | |
| SCHEMBL7432347 | 0.83 | KCNH2 (0.45) | KDM4EALDH1A1ACHECHRM1HTR1A | |
| SCHEMBL7435875 | 0.83 | ABCB11 (0.45) | KDM4EALDH1A1MAPK1ACHECHRM1 | |
| SCHEMBL7437790 | 0.83 | ABCB11 (0.45) | KDM4EALDH1A1ACHECHRM1HTR1A | |
| SCHEMBL7440743 | 0.82 | KDM4E (0.46) | KDM4EALDH1A1MAPK1ACHECHRM1 |
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-5070087-A | Aryl(alkyland alkylene)-N-((phenoxy and phenylthio)alkyl) aminoheterocyclics as cardiovascular, anthihistaminic, antisecretory and antiallergy agents | A. H. ROBINS COMPANY, INCORPORATED (US) | 1991-12-03 | — | — | US | disclosed |