Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 5/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | MMP12 | P39900 | 4/20 | 0.41 |
| ▸ | MMP13 | P45452 | 4/20 | 0.41 |
| ▸ | MMP2 | P08253 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | MMP14 | P50281 | 1/20 | 0.41 |
| ▸ | VCAM1 | P19320 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 2/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL9736501 | 1.00 | GAA (0.46) | GAAKMT2AALDH1A1TSHRLMNA | |
| SCHEMBL9735770 | 0.85 | GAA (0.46) | GAAKMT2AALDH1A1TSHRLMNA | |
| SCHEMBL11580110 | 0.82 | ALDH1A1 (0.52) | GAAKMT2AALDH1A1TSHRLMNA | |
| SCHEMBL11722702 | 0.77 | ALDH1A1 (0.47) | GAAKMT2AALDH1A1TSHRLMNA | |
| SCHEMBL9735154 | 0.77 | VCAM1 (0.48) | GAAALDH1A1TSHRLMNAVCAM1 | |
| SCHEMBL11726564 | 0.74 | GAA (0.47) | GAAKMT2AALDH1A1TSHRLMNA | |
| Glycerin SCHEMBL1704794 | 0.74 | GAA (0.55) | GAAKMT2AALDH1A1TSHRLMNA | |
| Glycerin SCHEMBL132813 | 0.74 | GAA (0.55) | GAAKMT2AALDH1A1TSHRLMNA | |
| SCHEMBL10548340 | 0.74 | ALDH1A1 (0.50) | GAAKMT2AALDH1A1TSHRLMNA | |
| SCHEMBL39190 | 0.74 | GAA (0.66) | GAAKMT2AALDH1A1TSHRLMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5093363-A | Antilipemic agents | SHIONOGI & CO., LTD. (JP) | 1992-03-03 | — | — | US | disclosed |
| EP-0414206-A2 | 2,4,6-Substituted phenol derivatives | SHIONOGI & CO., LTD. (JP) | 1991-02-27 | — | — | EP | disclosed |