Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | GALR3 | O60755 | 2/20 | 0.33 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | PGR | P06401 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 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 | |
|---|---|---|---|---|
| SCHEMBL9115523 | 0.87 | ALDH1A1 (0.39) | ALDH1A1LMNAHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL9117044 | 0.87 | ALDH1A1 (0.31) | ALDH1A1LMNAHSD17B10TSHR | |
| SCHEMBL9115815 | 0.87 | ALDH1A1 (0.31) | ALDH1A1LMNAHSD17B10TSHR | |
| SCHEMBL309351 | 0.82 | ALDH1A1 (0.50) | ALDH1A1LMNAHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL27756167 | 0.81 | ALDH1A1 (0.42) | ALDH1A1LMNAHSD17B10CYP4F2CYP4A11 | |
| SCHEMBL9261901 | 0.81 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL725624 | 0.80 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL832777 | 0.80 | ALDH1A1 (0.52) | ALDH1A1LMNAHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL10584206 | 0.80 | ALDH1A1 (0.46) | ALDH1A1LMNAHSD17B10SMN1; SMN2TP53 | |
| SCHEMBL9116960 | 0.79 | LMNA (0.45) | ALDH1A1LMNAHSD17B10SMN1; SMN2CYP3A4 |
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-1995022330-A1 | ANTIVIRAL AGENTS | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 1995-08-24 | — | — | WO | disclosed |