Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.59 |
| ▸ | POLB | P06746 | 5/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 11/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.47 |
| ▸ | HPGD | P15428 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 3/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | FYN | P06241 | 1/20 | 0.40 |
| ▸ | PRNP | P04156 | 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 | |
|---|---|---|---|---|
| SCHEMBL8162112 | 0.79 | HSD17B10 (0.64) | HSD17B10POLBKDM4ECYP1A2CYP3A4 | |
| SCHEMBL7378524 | 0.75 | KDM4E (0.73) | HSD17B10POLBKDM4ECYP1A2CYP3A4 | |
| SCHEMBL9023860 | 0.74 | LCK (0.54) | HSD17B10KDM4ECYP1A2CYP3A4CYP2C9 | |
| SCHEMBL9661237 | 0.74 | HSD17B10 (1.00) | HSD17B10POLBKDM4ECYP1A2CYP3A4 | |
| SCHEMBL14374015 | 0.73 | HSD17B10 (0.48) | HSD17B10POLBKDM4ECYP1A2CYP3A4 | |
| SCHEMBL11800712 | 0.72 | KDM4E (0.54) | HSD17B10POLBKDM4ECYP3A4ALDH1A1 | |
| SCHEMBL11797500 | 0.72 | ALDH1A1 (0.62) | HSD17B10POLBKDM4EALDH1A1HPGD | |
| SCHEMBL7466908 | 0.72 | KDM4E (0.68) | HSD17B10POLBKDM4ECYP3A4ALDH1A1 | |
| SCHEMBL6582728 | 0.71 | KDM4E (0.67) | HSD17B10POLBKDM4ECYP3A4ALDH1A1 | |
| SCHEMBL21635978 | 0.71 | KDM4E (0.52) | HSD17B10POLBKDM4ECYP1A2CYP3A4 |
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-3976780-A | Methods of protection against emesis in mammals by administration of a 3-alkoxy-thianaphthene-2-carboxamide | SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES L'ILE-DE-FRANCE (FR) | 1976-08-24 | — | — | US | disclosed |
| US-3954748-A | ANTIEMETICS | SOCIETE D'ETUDES SCIENTIFIQUES ET INDUSTRIELLES DE L'ILE-DE-FRANCE (FR) | 1976-05-04 | — | — | US | disclosed |