Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | MAOB | P27338 | 10/20 | 0.39 |
| ▸ | MAOA | P21397 | 9/20 | 0.39 |
| ▸ | APP | P05067 | 6/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 3/20 | 0.37 |
| ▸ | ACHE | P22303 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | AR | P10275 | 1/20 | 0.36 |
| ▸ | MCHR1 | Q99705 | 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 | |
|---|---|---|---|---|
| SCHEMBL4852988 | 0.94 | HRH1 (0.41) | ESR1HRH1MAOBSYKBCHE | |
| SCHEMBL4851055 | 0.90 | SYK (0.40) | ESR1HRH1MAOBMAOAAPP | |
| SCHEMBL4848478 | 0.90 | SYK (0.40) | ESR1HRH1MAOBMAOAAPP | |
| SCHEMBL4849810 | 0.88 | ABCB1 (0.43) | ESR1HRH1MAOBSYKBCHE | |
| SCHEMBL4850158 | 0.87 | SLC6A9 (0.41) | ESR1HRH1BCHEACHEKDM4E | |
| SCHEMBL4854570 | 0.87 | HRH1 (0.41) | ESR1HRH1BCHEACHEKDM4E | |
| SCHEMBL4853942 | 0.86 | AR (0.45) | ESR1HRH1MAOBMAOASYK | |
| SCHEMBL4846881 | 0.86 | MAOB (0.48) | MAOBBCHEACHEKDM4EALDH1A1 | |
| SCHEMBL4848288 | 0.85 | AR (0.41) | ESR1HRH1MAOBSYKBCHE | |
| SCHEMBL4849980 | 0.85 | SLC6A9 (0.42) | ESR1HRH1MAOBMAOASYK |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050227990-A1 | Aminoalkoxy-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2005-10-13 | — | — | US | claimed |
| US-7423181-B2 | in particular against bacterial and parasitic infections, fungi, and helminths; improved metabolic and physiochemical properties, bioavailability, solubility; 3-[4-(2-Dimethylamino-ethoxy)-2'-trifluoromethyl-biphenyl-3-yl]-1-(2-dimethylaminomethyl-phenyl)-propenone | LICA PHARMACEUTICALS A/S (DK) | 2008-09-09 | — | — | US | disclosed |
| US-20050227990-A1 | Aminoalkoxy-functional chalcones | LICA PHARMACEUTICALS A/S (DK) | 2005-10-13 | — | — | US | disclosed |