Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.44 |
| ▸ | TNFRSF1A | P19438 | 1/20 | 0.42 |
| ▸ | SLC6A9 | P48067 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.41 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.41 |
| ▸ | APP | P05067 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4854790 | 0.92 | ABCG2 (0.50) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4848031 | 0.91 | ABCG2 (0.46) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4856317 | 0.91 | ABCG2 (0.46) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4848487 | 0.90 | LMNA (0.46) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4847516 | 0.89 | ABCG2 (0.50) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4849336 | 0.87 | TNFRSF1A (0.44) | PDE4APDE4BPDE4CPDE4DTNFRSF1A | |
| SCHEMBL4848333 | 0.87 | PDE4A (0.46) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL14280885 | 0.87 | PDE4A (0.46) | ABCG2PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4853297 | 0.87 | BCHE (0.52) | ABCG2TNFRSF1AKDM4EMAPTL3MBTL1 | |
| SCHEMBL4846183 | 0.85 | LMNA (0.45) | ABCG2PDE4APDE4BPDE4CPDE4D |
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 |