Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | TNKS | O95271 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | PARP1 | P09874 | 2/20 | 0.48 |
| ▸ | HPGD | P15428 | 2/20 | 0.48 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TP53 | P04637 | 1/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | POLH | Q9Y253 | 1/20 | 0.46 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.45 |
| ▸ | TYR | P14679 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL1927674 | 0.82 | MAOB (0.53) | HDAC6CYP3A4MAPTTNKSALDH1A1 | |
| SCHEMBL16719694 | 0.82 | GABRP (0.48) | PTGS2GABRPGABRDGABRA1GABRB1 | |
| SCHEMBL28302252 | 0.79 | MAOB (0.65) | HDAC6CYP3A4MAPTTNKSALDH1A1 | |
| SCHEMBL21295722 | 0.75 | CYP2A6 (0.42) | CYP3A4ALDH1A1HPGDMEN1CYP2C9 | |
| SCHEMBL5030588 | 0.74 | ESR1 (0.50) | HDAC6CYP3A4MAPTTNKSALDH1A1 | |
| SCHEMBL16720104 | 0.73 | GSK3B (0.41) | TP53ESR1ESR2HIF1AMAOB | |
| SCHEMBL11669055 | 0.71 | — | — | |
| SCHEMBL7421312 | 0.71 | KDM4E (0.49) | MAPTTNKSALDH1A1HPGDMEN1 | |
| SCHEMBL5034697 | 0.71 | HDAC6 (0.55) | HDAC6CYP3A4MAPTTNKSALDH1A1 | |
| SCHEMBL16719665 | 0.70 | CYP1A1 (0.39) | ALDH1A1HPGDMEN1KMT2AESR1 |
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 |