Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.38 |
| ▸ | CASP1 | P29466 | 2/20 | 0.38 |
| ▸ | CASP7 | P55210 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 3/20 | 0.36 |
| ▸ | PDK4 | Q16654 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | BAZ2A | Q9UIF9 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.34 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL27347623 | 0.71 | KDM4E (0.43) | KDM4EGAAMAPT | |
| SCHEMBL6091612 | 0.70 | ALDH1A1 (0.56) | ERN1HSD17B10ALDH1A1KDM4EKMT2A | |
| SCHEMBL1080595 | 0.69 | CXCR4 (0.38) | ERN1HSD17B10ALDH1A1KDM4EKMT2A | |
| SCHEMBL6089632 | 0.69 | HSD17B10 (0.44) | ERN1HSD17B10CASP1CASP7ALDH1A1 | |
| SCHEMBL5406488 | 0.67 | TYMP (0.38) | ERN1HSD17B10CASP1CASP7ALDH1A1 | |
| SCHEMBL19119615 | 0.66 | MAP4K1 (0.56) | — | |
| SCHEMBL14606256 | 0.65 | HRH3 (0.52) | HSD17B10ALDH1A1KMT2AMEN1CXCR4 | |
| SCHEMBL14333961 | 0.64 | HPGD (0.43) | ERN1HSD17B10ALDH1A1KDM4EKMT2A | |
| SCHEMBL30259715 | 0.61 | CXCR4 (0.62) | HSD17B10ALDH1A1KMT2AMEN1CXCR4 | |
| SCHEMBL12615263 | 0.61 | CXCR4 (0.49) | ERN1HSD17B10ALDH1A1KMT2AMEN1 |
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-2024011294-A1 | ANTI-GIARDIAL COMPOUNDS | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 2024-01-18 | — | — | WO | disclosed |