Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.51 |
| ▸ | APP | P05067 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 3/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.48 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| Propyl 3-(4-Chlorophenyl)Acrylate SCHEMBL19244385 | 0.86 | APP (0.64) | CYP1A2APPLMNATDP1MEN1 | |
| Propyl 3-(4-Chlorophenyl)Acrylate SCHEMBL19244387 | 0.86 | APP (0.64) | CYP1A2APPLMNATDP1MEN1 | |
| SCHEMBL11547633 | 0.85 | PTGS2 (0.56) | CYP1A2MAOBLMNAPPARAMEN1 | |
| SCHEMBL11621432 | 0.83 | CYP1A2 (0.52) | CYP1A2MAOBAPPLMNAMEN1 | |
| SCHEMBL19244225 | 0.82 | APP (0.62) | APPLMNATDP1MEN1KMT2A | |
| SCHEMBL11546773 | 0.81 | CYP1A2 (0.57) | CYP1A2MAOBPPARAMEN1KMT2A | |
| SCHEMBL19244431 | 0.81 | APP (0.61) | MAOBAPPLMNATDP1KMT2A | |
| SCHEMBL19244350 | 0.81 | APP (0.62) | APPLMNATDP1ABCG2 | |
| SCHEMBL19244333 | 0.81 | APP (0.66) | MAOBAPPLMNATDP1MEN1 | |
| SCHEMBL19244334 | 0.81 | APP (0.66) | MAOBAPPLMNATDP1MEN1 |
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-4073935-A | Substituted propanol-(2)-derivatives and their nicotinic acid esters, and process for their preparation, and the use thereof as hypolipemic drugs | KLINGE PHARMA GMBH & CO. (DT) | 1978-02-14 | — | — | US | claimed |