Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | ATM | Q13315 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.51 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.51 |
| ▸ | CRHBP | P24387 | 1/20 | 0.51 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.51 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.47 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | PGR | P06401 | 1/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.47 |
| ▸ | PDE4A | P27815 | 1/20 | 0.47 |
| ▸ | KDR | P35968 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9146862 | 0.82 | CYP3A4 (0.59) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL5497313 | 0.80 | ALDH1A1 (0.56) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL5497310 | 0.80 | ALDH1A1 (0.56) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL28491533 | 0.79 | CYP3A4 (0.56) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL24217541 | 0.79 | CYP3A4 (0.51) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL15238959 | 0.78 | CYP1A2 (0.59) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL10840510 | 0.78 | CYP1A2 (0.59) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL406395 | 0.77 | ALDH1A1 (0.66) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL2606237 | 0.77 | ALDH1A1 (0.56) | CYP3A4ATMALDH1A1HSD17B10TDP1 | |
| SCHEMBL2606235 | 0.77 | ALDH1A1 (0.56) | CYP3A4ATMALDH1A1HSD17B10TDP1 |
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-4190401-A1 | NOVEL STIRIPENTOL DERIVATIVE AND USE THEREOF | National University Corporation Okayama University (JP) | 2023-06-07 | — | — | EP | disclosed |