Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | PPARG | P37231 | 2/20 | 0.39 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.39 |
| ▸ | ITGA2B | P08514 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL8634143 | 0.93 | SLC2A1 (0.47) | SLC2A1LMNAPOLBMAPTCHRM1 | |
| SCHEMBL8630600 | 0.79 | HRH3 (0.55) | POLBMAPTNPC1HTR2APPARG | |
| Hydrochloric Acid SCHEMBL8837964 | 0.78 | ITGB3 (0.45) | ITGB3ITGA2BHRH3SLC6A4 | |
| SCHEMBL8635011 | 0.76 | ITGB3 (0.48) | ITGB3ITGA2BHRH3ALDH1A1DRD4 | |
| SCHEMBL8635826 | 0.75 | HRH3 (0.54) | MAPTNPC1HTR2APPARGITGB3 | |
| Hydrochloric Acid SCHEMBL8837973 | 0.75 | ITGB3 (0.47) | ITGB3ITGA2BHRH3ALDH1A1DRD4 | |
| Hydrochloric Acid SCHEMBL8681084 | 0.74 | HRH3 (0.53) | MAPTNPC1HTR2APPARGITGB3 | |
| SCHEMBL11213942 | 0.72 | SLC6A4 (0.53) | LMNAALDH1A1SLC6A4 | |
| SCHEMBL7399787 | 0.71 | ITGB3 (0.48) | SLC2A1LMNAPOLBMAPTCHRM1 | |
| SCHEMBL8635355 | 0.70 | GAA (0.55) | LMNAHTR2AALDH1A1HSD17B10SMN1; SMN2 |
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-5750754-A | TERTIARY BUTYL 3-METHYL-4-SUBSTITUTED BUTYRATE; CHEMICAL INTERMEDIATES FOR ANTICAOGULANT DRUGS | ZENECA LIMITED (GB) | 1998-05-12 | — | — | US | disclosed |