Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | THRA | P10827 | 4/20 | 0.52 |
| ▸ | THRB | P10828 | 3/20 | 0.52 |
| ▸ | LTB4R | Q15722 | 2/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.43 |
| ▸ | CYSLTR2 | Q9NS75 | 1/20 | 0.43 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 3/20 | 0.41 |
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.41 |
| ▸ | ESR1 | P03372 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4856637 | 0.86 | LMNA (0.45) | BCHEACHE | |
| SCHEMBL4853514 | 0.85 | NR1H4 (0.47) | BCHEACHE | |
| SCHEMBL4853736 | 0.84 | BCHE (0.52) | BCHEACHEESR1 | |
| SCHEMBL4854708 | 0.84 | CYSLTR2 (0.59) | THRATHRBCYSLTR2PTPN11BCHE | |
| SCHEMBL4845786 | 0.84 | CYSLTR2 (0.59) | THRATHRBCYSLTR2PTPN11BCHE | |
| SCHEMBL4853345 | 0.84 | RELA (0.48) | BCHEACHE | |
| SCHEMBL4846169 | 0.83 | BCHE (0.42) | BCHEACHE | |
| SCHEMBL7187007 | 0.82 | SMPD1 (0.56) | THRATHRBLTB4RSMPD1CYSLTR2 | |
| SCHEMBL4848288 | 0.81 | AR (0.41) | THRATHRBPTPN11BCHEACHE | |
| SCHEMBL7194183 | 0.81 | SMPD1 (0.54) | THRATHRBLTB4RSMPD1CYSLTR2 |
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 |