Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 9/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.43 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.43 |
| ▸ | SLC6A9 | P48067 | 2/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 2/20 | 0.38 |
| ▸ | ACHE | P22303 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL4855932 | 1.00 | ABCB1 (0.46) | ABCB1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4857214 | 0.84 | SYK (0.44) | SLC6A9SYKBCHEACHE | |
| SCHEMBL4856632 | 0.84 | SYK (0.44) | SLC6A9SYKBCHEACHE | |
| SCHEMBL4849679 | 0.84 | HDAC3 (0.47) | ABCB1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4853507 | 0.84 | MAOA (0.44) | SLC6A9SYKBCHEACHE | |
| SCHEMBL4857314 | 0.84 | MAOA (0.44) | SLC6A9SYKBCHEACHE | |
| SCHEMBL4846158 | 0.84 | BCHE (0.41) | HDAC4SLC6A9SYKBCHEACHE | |
| SCHEMBL4854696 | 0.84 | BCHE (0.41) | HDAC4SLC6A9SYKBCHEACHE | |
| SCHEMBL4853732 | 0.83 | BCHE (0.54) | SLC6A9SYKBCHEACHE | |
| SCHEMBL4854231 | 0.83 | BCHE (0.54) | SLC6A9SYKBCHEACHE |
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 |
|---|---|---|---|---|---|---|---|
| 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 |