Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.60 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.54 |
| ▸ | GSK3B | P49841 | 2/20 | 0.54 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | CES1 | P23141 | 1/20 | 0.48 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.48 |
| ▸ | MMP1 | P03956 | 1/20 | 0.47 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.47 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.46 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.46 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | PPARD | Q03181 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 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 | |
|---|---|---|---|---|
| SCHEMBL11204474 | 0.85 | ALDH1A1 (0.56) | PDPK1SRD5A2ALDH1A1MAPTHDAC1 | |
| SCHEMBL18860300 | 0.84 | PTPN1 (0.59) | PDPK1PTPN1GSK3BCES2CES1 | |
| SCHEMBL19642328 | 0.84 | PDPK1 (0.65) | PDPK1PTPN1GSK3BCES2CES1 | |
| SCHEMBL19660004 | 0.83 | PTPN1 (0.50) | PDPK1PTPN1GSK3BCES2CES1 | |
| SCHEMBL11151625 | 0.81 | NPSR1 (0.55) | CES2SRD5A2ALDH1A1 | |
| SCHEMBL11780105 | 0.81 | PDPK1 (0.61) | PDPK1PTPN1GSK3BCES2CES1 | |
| SCHEMBL4686815 | 0.81 | MEN1 (0.54) | PTPN1CES2CES1HSD11B1ALDH1A1 | |
| SCHEMBL7800743 | 0.80 | PDPK1 (0.60) | PDPK1PTPN1GSK3BCES2CES1 | |
| SCHEMBL8775647 | 0.79 | ALDH1A1 (0.58) | GSK3BCES2CES1ALDH1A1MAPT | |
| SCHEMBL135355 | 0.78 | L3MBTL1 (0.66) | PTPN1GSK3BCES1NR4A2ALDH1A1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0010347-B1 | NOVEL SUBSTITUTED OMEGA-AROYL(PROPIONYL OR BUTYRYL)-L-PROLINES, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION | AMERICAN CYANAMID COMPANY (US) | 1983-11-09 | — | — | EP | disclosed |
| US-4226775-A | HYPOTENSIVE AGENTS | AMERICAN CYANAMID COMPANY (US) | 1980-10-07 | — | — | US | disclosed |
| EP-0010347-A1 | Novel substituted omega-aroyl(propionyl or butyryl)-L-prolines, pharmaceutical compositions containing them and processes for their preparation | AMERICAN CYANAMID COMPANY (US) | 1980-04-30 | — | — | EP | disclosed |