Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 14/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.44 |
| ▸ | HTR1B | P28222 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MGLL | Q99685 | 1/20 | 0.42 |
| ▸ | ABHD6 | Q9BV23 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3688257 | 0.79 | ALDH1A1 (0.51) | HTR1AHTR1DHTR1BKDM4EALDH1A1 | |
| SCHEMBL6141581 | 0.78 | HTR1A (0.44) | HTR1AHTR1DHTR1BKDM4EALDH1A1 | |
| SCHEMBL4855833 | 0.74 | MAOB (0.58) | MAOBKDM4EALDH1A1 | |
| SCHEMBL14922281 | 0.74 | HRH3 (0.57) | KDM4EALDH1A1 | |
| SCHEMBL8614407 | 0.73 | ROCK1 (0.54) | KDM4EALDH1A1MGLLABHD6 | |
| SCHEMBL3690359 | 0.72 | GAA (0.57) | KDM4EALDH1A1 | |
| SCHEMBL14590673 | 0.71 | NOTUM (0.64) | KDM4EALDH1A1 | |
| SCHEMBL17324776 | 0.70 | HRH3 (0.47) | — | |
| SCHEMBL3683974 | 0.68 | HSD11B1 (0.38) | MAOBHTR1BKDM4EALDH1A1 | |
| SCHEMBL12853694 | 0.68 | MGLL (0.56) | KDM4EALDH1A1MGLLABHD6 |
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 |