Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | THRA | P10827 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.43 |
| ▸ | BCHE | P06276 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | LSS | P48449 | 1/20 | 0.42 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | PSEN1 | P49768 | 1/20 | 0.40 |
| ▸ | PSEN2 | P49810 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4846138 | 1.00 | KDM4E (0.46) | KDM4EALDH1A1THRATHRBBCHE | |
| SCHEMBL4846156 | 0.92 | KDM4E (0.46) | KDM4EALDH1A1BCHEACHELSS | |
| SCHEMBL4857406 | 0.84 | BCHE (0.58) | BCHEACHEHRH3MAOBCXCL12 | |
| SCHEMBL4846784 | 0.84 | BCHE (0.58) | BCHEACHEHRH3MAOBCXCL12 | |
| SCHEMBL4852227 | 0.81 | KDM4E (0.56) | KDM4EALDH1A1BCHEACHEMAOB | |
| SCHEMBL4849629 | 0.81 | KDM4E (0.56) | KDM4EALDH1A1BCHEACHEMAOB | |
| SCHEMBL4856209 | 0.81 | MAPT (0.52) | KDM4EALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4846123 | 0.81 | MAPT (0.52) | KDM4EALDH1A1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL4846787 | 0.80 | BCHE (0.61) | KDM4EALDH1A1BCHEACHEHRH3 | |
| SCHEMBL4849641 | 0.77 | KDM4E (0.56) | KDM4EALDH1A1THRATHRBBCHE |
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 |