Known targets — ChEMBL curated mechanism
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
The experimentally established mechanism targets of E319. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.64 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.64 |
| ▸ | HPGD | P15428 | 2/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.64 |
| ▸ | TP53 | P04637 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.64 |
| ▸ | THRB | P10828 | 1/20 | 0.64 |
| ▸ | CASP1 | P29466 | 1/20 | 0.64 |
| ▸ | RECQL | P46063 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.61 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.61 |
| ▸ | MIF | P14174 | 1/20 | 0.61 |
| ▸ | TYR | P14679 | 1/20 | 0.61 |
| ▸ | HTT | P42858 | 1/20 | 0.61 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.61 |
| ▸ | NR1H4 | Q96RI1 | 5/20 | 0.49 |
| ▸ | GAA | P10253 | 4/20 | 0.43 |
| ▸ | APP | P05067 | 3/20 | 0.41 |
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 | |
|---|---|---|---|---|
| E319 SCHEMBL10625736 | 0.80 | ALDH1A1 (0.95) | ALDH1A1HSD17B10ALOX15HPGDTP53 | |
| Sulfuric Acid SCHEMBL211558 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Sulfuric Acid SCHEMBL121335 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Hydroquinone SCHEMBL9653092 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Hydroquinone SCHEMBL9498831 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Sulfuric Acid SCHEMBL9722978 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Sulfuric Acid SCHEMBL6547631 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Sulfuric Acid SCHEMBL11535284 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| Sulfuric Acid SCHEMBL6288836 | 0.80 | ALDH1A1 (1.00) | ALDH1A1HSD17B10ALOX15HPGDHIF1A | |
| SCHEMBL8060147 | 0.78 | NR1H4 (0.60) | ALDH1A1HSD17B10ALOX15HPGDTP53 |
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-4416980-A | High-contrast light-sensitive silver halide photographic material | KONISHIROKU PHOTO INDUSTRY CO., LTD. (JP) | 1983-11-22 | — | — | US | disclosed |