Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.44 |
| ▸ | DHFR | P00374 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | APAF1 | O14727 | 2/20 | 0.39 |
| ▸ | RECQL | P46063 | 1/20 | 0.39 |
| ▸ | PDE9A | O76083 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CASP7 | P55210 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | IDH1 | O75874 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | GFER | P55789 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18921841 | 0.89 | GAA (0.48) | GAASMN1; SMN2TP53RAB9AALDH1A1 | |
| SCHEMBL18921833 | 0.88 | GAA (0.47) | GAASMN1; SMN2TP53RAB9AMAPT | |
| SCHEMBL18921838 | 0.88 | GAA (0.47) | GAASMN1; SMN2TP53RAB9AALDH1A1 | |
| SCHEMBL18921832 | 0.87 | GAA (0.65) | GAASMN1; SMN2TP53RAB9AALDH1A1 | |
| SCHEMBL18921815 | 0.72 | GAA (0.66) | GAASMN1; SMN2TP53RAB9AALDH1A1 | |
| SCHEMBL18921823 | 0.72 | NPC1 (0.43) | GAASMN1; SMN2RAB9AALDH1A1DHFR | |
| SCHEMBL6759841 | 0.70 | RAB9A (0.62) | GAASMN1; SMN2TP53RAB9AALDH1A1 | |
| SCHEMBL18921814 | 0.69 | NPC1 (0.45) | GAASMN1; SMN2RAB9AALDH1A1MAPT | |
| SCHEMBL10642154 | 0.68 | PKM (0.72) | GAASMN1; SMN2TP53RAB9AALDH1A1 | |
| SCHEMBL24847112 | 0.68 | FPR2 (0.56) | SMN1; SMN2TP53RAB9AALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017095051-A2 | COMPOSITION CONTAINING NAPHTHOQUINONE DERIVATIVE FOR CONTROLLING HARMFUL ALGAE AND METHOD FOR CONTROLLING HARMFUL ALGAE USING SAME | 한양대학교 산학협력단 | 2017-06-08 | — | — | WO | disclosed |