Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.71 |
| ▸ | RECQL | P46063 | 1/20 | 0.71 |
| ▸ | LCK | P06239 | 4/20 | 0.52 |
| ▸ | NQO2 | P16083 | 1/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | TTR | P02766 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | MMP2 | P08253 | 2/20 | 0.44 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 2/20 | 0.44 |
| ▸ | MMP9 | P14780 | 2/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28313721 | 0.89 | ALDH1A1 (0.68) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL28313741 | 0.88 | ALDH1A1 (0.70) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL30812742 | 0.84 | ALDH1A1 (1.00) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL197852 | 0.84 | ALDH1A1 (1.00) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL30884134 | 0.84 | ALDH1A1 (1.00) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL197853 | 0.84 | ALDH1A1 (1.00) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL8848354 | 0.83 | APP (0.61) | ALDH1A1CYP3A4RECQLLCKHSD17B10 | |
| SCHEMBL30355320 | 0.83 | APP (0.61) | ALDH1A1CYP3A4RECQLLCKHSD17B10 | |
| SCHEMBL8757053 | 0.83 | ALDH1A1 (0.56) | ALDH1A1CYP3A4RECQLLCKNQO2 | |
| SCHEMBL9680538 | 0.83 | APP (0.61) | ALDH1A1CYP3A4RECQLLCKHSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4959391-A | LIPOXYGENASE INHIBITORS, LEUKOTRIENE DISEASES | GRUENENTHAL GMBH (DE) | 1990-09-25 | — | — | US | disclosed |
| US-4760087-A | 5-lipoxygenase inhibitor | GRUENENTHAL GMBH (DE) | 1988-07-26 | — | — | US | disclosed |
| EP-0202529-A2 | Phenol derivatives, pharmaceutical compositions containing them and processes for the preparation of these compounds and pharmaceutical compositions | Grünenthal GmbH (DE) | 1986-11-26 | — | — | EP | disclosed |