Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | PTPN1 | P18031 | 9/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.39 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.36 |
| ▸ | PTGES | O14684 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | STAT3 | P40763 | 1/20 | 0.36 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16166184 | 0.78 | HTT (0.43) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL9788485 | 0.70 | PTPN1 (0.52) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL16445891 | 0.69 | HMGCR (0.56) | HTTHPGDMEN1CYP3A4KMT2A | |
| SCHEMBL11155846 | 0.67 | PTPN1 (0.48) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL5165075 | 0.67 | MEN1 (0.66) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL16166295 | 0.66 | ALOX5 (0.40) | MEN1CYP3A4KMT2APTPN1ALOX5 | |
| SCHEMBL5168069 | 0.65 | HTT (0.66) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL10516948 | 0.65 | TNFSF11 (0.40) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL11150704 | 0.65 | PTGS1 (0.45) | HTTHPGDMEN1CYP1A2CYP3A4 | |
| SCHEMBL5164363 | 0.64 | HTT (0.59) | HTTHPGDMEN1CYP1A2CYP3A4 |
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-2984072-A1 | SYNTHETIC ANALOGUES OF XANTHOHUMOL | Universita Di Pisa (IT) | 2016-02-17 | — | — | EP | disclosed |
| WO-2014167481-A1 | SYNTHETIC ANALOGUES OF XANTHOHUMOL | UNIVERSITA' DI PISA (IT) | 2014-10-16 | — | — | WO | disclosed |