Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.63 |
| ▸ | MEN1 | O00255 | 2/20 | 0.63 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.63 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | RAB9A | P51151 | 1/20 | 0.63 |
| ▸ | ABCG2 | Q9UNQ0 | 6/20 | 0.60 |
| ▸ | APP | P05067 | 2/20 | 0.60 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.59 |
| ▸ | USP2 | O75604 | 1/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.58 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.56 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.56 |
| ▸ | XDH | P47989 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL4853023 | 0.95 | MAPT (0.61) | MAPTMEN1KMT2ANPC1RAB9A | |
| SCHEMBL4845309 | 0.92 | ABCG2 (0.60) | MAPTABCG2APPCYP1A2CYP3A4 | |
| SCHEMBL4851228 | 0.92 | ABCG2 (0.60) | MAPTABCG2APPCYP1A2CYP3A4 | |
| SCHEMBL4848357 | 0.89 | MAOB (0.60) | ABCG2APPCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4851385 | 0.89 | APP (0.59) | MAPTMEN1KMT2ANPC1RAB9A | |
| SCHEMBL4846963 | 0.87 | TUBB1 (0.56) | ABCG2APPCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL4852954 | 0.87 | ABCG2 (0.59) | MAPTABCG2APPCYP1A2CYP3A4 | |
| SCHEMBL29443563 | 0.87 | MAPT (0.82) | MAPTMEN1KMT2ANPC1RAB9A | |
| SCHEMBL4846088 | 0.85 | MAOB (0.71) | MAPTMEN1KMT2AAPPTNFRSF1A | |
| SCHEMBL4853318 | 0.85 | MAOB (0.62) | APPBCHEACHE |
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 |