Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.51 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.47 |
| ▸ | EGFR | P00533 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | CES1 | P23141 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL4879469 | 0.90 | KMT2A (0.49) | KMT2AALDH1A1KDM4EEGFRNPC1 | |
| SCHEMBL10478276 | 0.83 | USP2 (0.44) | KMT2AUSP2ALDH1A1KDM4EEGFR | |
| SCHEMBL2126591 | 0.80 | LMNA (0.56) | KMT2AALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL864716 | 0.79 | MAPT (0.61) | KMT2AALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL27830157 | 0.78 | L3MBTL1 (0.50) | KMT2AALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL11617258 | 0.78 | TDP1 (0.55) | KMT2AALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL29050757 | 0.78 | MAPT (0.50) | KMT2AALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL1742078 | 0.77 | TSHR (0.49) | KMT2AKDM4ENPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28061828 | 0.77 | MAPK1 (0.55) | KMT2AALDH1A1KDM4ENPC1RAB9A | |
| SCHEMBL27930147 | 0.76 | BCHE (0.49) | KMT2ACYP3A4 |
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 |