Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPARG | P37231 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HTR2C | P28335 | 1/20 | 0.38 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL9810689 | 1.00 | PPARG (0.43) | PPARGALDH1A1HSD17B10TSHRLMNA | |
| SCHEMBL9810416 | 1.00 | PPARG (0.43) | PPARGALDH1A1HSD17B10TSHRLMNA | |
| SCHEMBL9810272 | 0.99 | PPARG (0.41) | PPARGALDH1A1HSD17B10TSHRLMNA | |
| SCHEMBL9810614 | 0.95 | ALDH1A1 (0.41) | PPARGALDH1A1TSHRLMNAHTR2C | |
| SCHEMBL9810360 | 0.90 | ALDH1A1 (0.42) | ALDH1A1TSHRLMNAHTR2C | |
| SCHEMBL9810450 | 0.89 | PPARG (0.42) | PPARGALDH1A1HSD17B10TSHRLMNA | |
| SCHEMBL9810440 | 0.89 | MEN1 (0.47) | ALDH1A1TSHRHSP90AA1TP53 | |
| SCHEMBL9810434 | 0.89 | MEN1 (0.47) | ALDH1A1TSHRHSP90AA1TP53 | |
| SCHEMBL9810613 | 0.89 | MEN1 (0.47) | ALDH1A1TSHRHSP90AA1TP53 | |
| SCHEMBL9810588 | 0.89 | MEN1 (0.47) | ALDH1A1TSHRHSP90AA1TP53 |
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 |
|---|---|---|---|---|---|---|---|
| US-5068389-A | TERTIARY ALCOHOLS | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-11-26 | — | — | US | disclosed |