Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MLYCD | O95822 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL19963175 | 0.82 | ALDH1A1 (0.40) | ALDH1A1TP53HSD17B10LMNASMN1; SMN2 | |
| SCHEMBL21986133 | 0.74 | ALDH1A1 (0.43) | ALDH1A1TP53HSD17B10TSHRMAPK1 | |
| SCHEMBL21988171 | 0.71 | TAAR1 (0.34) | ALDH1A1TP53HSD17B10TSHRMAPK1 | |
| SCHEMBL21986113 | 0.69 | MAPK1 (0.46) | ALDH1A1TP53HSD17B10TSHRMAPK1 | |
| SCHEMBL21985769 | 0.69 | MAPK1 (0.46) | ALDH1A1TP53HSD17B10TSHRMAPK1 | |
| SCHEMBL1027879 | 0.68 | ALDH1A1 (0.58) | ALDH1A1TP53HSD17B10TSHRMAPK1 | |
| SCHEMBL21985990 | 0.67 | ALDH1A1 (0.38) | ALDH1A1TP53LMNASMN1; SMN2MLYCD | |
| SCHEMBL15018955 | 0.66 | ALDH1A1 (0.50) | ALDH1A1TP53HSD17B10TSHRMAPK1 | |
| SCHEMBL1114995 | 0.66 | ALDH1A1 (0.56) | ALDH1A1TP53MAPK1LMNASMN1; SMN2 | |
| SCHEMBL21988168 | 0.66 | ESR1 (0.37) | ALDH1A1TP53HSD17B10LMNASMN1; SMN2 |
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 |