Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MLYCD | O95822 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.32 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.32 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.32 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.32 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.32 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.32 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.32 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL21986001 | 0.78 | ALDH1A1 (0.37) | MAPK1ALDH1A1HSD17B10TP53TSHR | |
| SCHEMBL21985769 | 0.75 | MAPK1 (0.46) | MAPK1ALDH1A1HSD17B10TP53TSHR | |
| SCHEMBL21986138 | 0.71 | ALDH1A1 (0.48) | MAPK1ALDH1A1HSD17B10TP53TSHR | |
| SCHEMBL13809310 | 0.70 | ALDH1A1 (0.52) | MAPK1ALDH1A1HSD17B10TP53TSHR | |
| SCHEMBL21986106 | 0.69 | ALDH1A1 (0.42) | MAPK1ALDH1A1HSD17B10TP53TSHR | |
| SCHEMBL21988171 | 0.68 | TAAR1 (0.34) | MAPK1ALDH1A1HSD17B10TP53TSHR | |
| SCHEMBL17933668 | 0.68 | HDAC3 (0.46) | ALDH1A1HSD17B10TSHRMLYCDHDAC1 | |
| SCHEMBL19963121 | 0.67 | MLYCD (0.41) | ALDH1A1MLYCDHDAC1POLBSMN1; SMN2 | |
| SCHEMBL14163317 | 0.67 | MLYCD (0.41) | ALDH1A1HSD17B10MLYCDHDAC1MAPT | |
| SCHEMBL7089903 | 0.67 | ALDH1A1 (0.52) | MAPK1ALDH1A1HSD17B10TP53TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-3395804-B1 | NOVEL SPIROQUINONE DERIVATIVE COMPOUND, PRODUCTION METHOD THEREOF, AND PHARMACEUTICAL COMPOSITION FOR PREVENTING OR TREATING NEUROLOGICAL DISORDERS WHICH CONTAINS SAME AS ACTIVE INGREDIENT | UNIV GACHON IND ACAD COOP FOUND (KR) | 2020-05-13 | — | — | EP | disclosed |