Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.37 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.37 |
| ▸ | AHR | P35869 | 3/20 | 0.36 |
| ▸ | CMA1 | P23946 | 1/20 | 0.36 |
| ▸ | TYR | P14679 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.33 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.33 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 2/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | APP | P05067 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL13201332 | 0.80 | APP (0.53) | HDAC6HSD17B1HSD17B2AHRCMA1 | |
| SCHEMBL24177393 | 0.73 | HDAC6 (0.48) | HDAC6HSD17B1HSD17B2AHRCMA1 | |
| SCHEMBL3807869 | 0.72 | ESR1 (0.49) | HDAC6HSD17B1HSD17B2MAPTMEN1 | |
| SCHEMBL7259815 | 0.72 | NPC1 (0.47) | AHRCMA1TYRBRD4ENPP2 | |
| SCHEMBL20920740 | 0.71 | HDAC6 (0.39) | HDAC6HSD17B1HSD17B2AHRCMA1 | |
| SCHEMBL16719703 | 0.70 | APP (0.37) | HDAC6HSD17B1HSD17B2ESR1ESR2 | |
| SCHEMBL7260046 | 0.70 | NPC1 (0.46) | AHRCMA1TYRBRD4ENPP2 | |
| SCHEMBL16720495 | 0.70 | TYR (0.46) | AHRCMA1TYRBRD4ENPP2 | |
| SCHEMBL16720556 | 0.70 | HSD17B1 (0.61) | HSD17B1HSD17B2ESR1ESR2APP | |
| SCHEMBL27659363 | 0.70 | HDAC6 (0.40) | HDAC6HSD17B1HSD17B2ESR1ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3068758-A1 | EBNA1 INHIBITORS AND THEIR METHOD OF USE | The Wistar Institute Of Anatomy And Biology (US) | 2016-09-21 | — | — | EP | disclosed |
| WO-2015073864-A1 | EBNA1 INHIBITORS AND THEIR METHOD OF USE | THE WISAR INSTITUTE OF ANATOMY AND BIOLOGY (US) | 2015-05-21 | — | — | WO | disclosed |