Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.60 |
| ▸ | HSD17B1 | P14061 | 10/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.58 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 2/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | STS | P08842 | 5/20 | 0.53 |
| ▸ | ESR1 | P03372 | 3/20 | 0.53 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.53 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.53 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.53 |
| ▸ | CA2 | P00918 | 1/20 | 0.53 |
| ▸ | CA4 | P22748 | 1/20 | 0.53 |
| ▸ | CA6 | P23280 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL22070255 | 0.91 | KDM4E (0.72) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| SCHEMBL11143012 | 0.91 | KDM4E (0.72) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| Estrone SCHEMBL11228733 | 0.90 | HSD17B1 (0.66) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| SCHEMBL22070254 | 0.87 | CYP3A4 (0.71) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| SCHEMBL12186933 | 0.85 | KDM4E (0.74) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| SCHEMBL8903503 | 0.85 | KDM4E (0.74) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| SCHEMBL11143717 | 0.83 | HSD17B1 (0.83) | HSD17B1CYP3A4LMNAMAPTSTS | |
| SCHEMBL3322364 | 0.81 | CYP3A4 (0.66) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| SCHEMBL26659900 | 0.81 | CYP3A4 (0.66) | KDM4EALDH1A1HSD17B1CYP3A4LMNA | |
| Estrone SCHEMBL11143016 | 0.80 | HSD17B1 (0.81) | KDM4EALDH1A1HSD17B1CYP3A4LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4323647-A | IMMOBILIZED ENZYMES SEPARATION | UNIVERSITY OF MIAMI (US) | 1982-04-06 | — | — | US | disclosed |