Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.39 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 6/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | NMT2 | O60551 | 1/20 | 0.36 |
| ▸ | NMT1 | P30419 | 1/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | MAOB | P27338 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL4856175 | 0.91 | PTPN11 (0.40) | HRH1PTPN11BACE1CYP1A2CYP3A4 | |
| SCHEMBL4848033 | 0.91 | PTPN11 (0.40) | HRH1PTPN11BACE1CYP1A2CYP3A4 | |
| SCHEMBL4854470 | 0.90 | KDM4E (0.43) | HRH1PTPN11SLC6A9NMT2NMT1 | |
| SCHEMBL4847450 | 0.88 | SLC6A9 (0.43) | HRH1SLC6A9NMT2NMT1PTPN1 | |
| SCHEMBL4845311 | 0.87 | MAOB (0.42) | MAOB | |
| SCHEMBL4852923 | 0.86 | SLC6A9 (0.37) | PTPN11SLC6A9NMT2NMT1PTPN1 | |
| SCHEMBL4853384 | 0.86 | PTPN11 (0.37) | PTPN11SLC6A9NMT2NMT1PTPN1 | |
| SCHEMBL4849688 | 0.85 | SLC6A9 (0.41) | SLC6A9LMNAMAOBKDM4E | |
| SCHEMBL4854149 | 0.85 | BACE1 (0.52) | BACE1TP53L3MBTL1LMNAMAOB | |
| SCHEMBL4852335 | 0.84 | SLC6A9 (0.40) | HRH1SLC6A9NMT2NMT1PTPN1 |
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 |