Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.60 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.45 |
| ▸ | ACLY | P53396 | 2/20 | 0.44 |
| ▸ | ACACA | Q13085 | 2/20 | 0.44 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | FNTA | P49354 | 1/20 | 0.38 |
| ▸ | FNTB | P49356 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | PTGES | O14684 | 1/20 | 0.35 |
| ▸ | PREP | P48147 | 1/20 | 0.35 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.35 |
| ▸ | CDC25B | P30305 | 1/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL5823474 | 0.85 | HSD11B1 (0.57) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| SCHEMBL17057017 | 0.82 | ACLY (0.65) | HSD11B1NR1H4ACLYACACAPTPN11 | |
| SCHEMBL5824245 | 0.81 | HSD11B1 (0.69) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| Cycloartenone SCHEMBL29504219 | 0.81 | HSD11B1 (0.61) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| Mangiferonic Acid SCHEMBL30415919 | 0.80 | ACLY (0.70) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| Mangiferonic Acid SCHEMBL29873759 | 0.80 | ACLY (0.70) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| SCHEMBL29934719 | 0.79 | PTPN11 (0.71) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| SCHEMBL31237297 | 0.78 | HSD11B1 (0.82) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| SCHEMBL30741399 | 0.78 | HSD11B1 (0.62) | HSD11B1ACLYACACAPTPN11MAPK1 | |
| SCHEMBL5824299 | 0.77 | HSD11B1 (0.61) | HSD11B1NR1H4ACLYACACAFNTA |
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 |
|---|---|---|---|---|---|---|---|
| CN-114746430-A | Quinone-, hydroquinone-and naphthoquinone-analogues of vattinoquinone for the treatment of mitochondrial disorders | 康德生物医疗有限公司 | 2022-07-12 | — | — | CN | disclosed |