Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | MAOA | P21397 | 4/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.45 |
| ▸ | MAOB | P27338 | 1/20 | 0.45 |
| ▸ | PRKCI | P41743 | 1/20 | 0.45 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL661560 | 0.97 | ACHE (0.54) | ACHEMAOAHSD17B1PTGS2MAOB | |
| SCHEMBL1274990 | 0.93 | ACHE (0.54) | ACHEMAOAHSD17B1PTGS2MAOB | |
| SCHEMBL1545375 | 0.90 | ACHE (0.54) | ACHEMAOAHSD17B1PTGS2MAOB | |
| SCHEMBL662848 | 0.90 | ACHE (0.57) | ACHEMAOAPTGS2CHRNA7 | |
| SCHEMBL9621080 | 0.86 | KMT2A (0.53) | ACHEMAOAHSD17B1 | |
| SCHEMBL9621112 | 0.86 | KMT2A (0.53) | ACHEMAOAHSD17B1 | |
| SCHEMBL6199828 | 0.83 | PTGS2 (0.56) | ACHEMAOAHSD17B1PTGS2CHRNA7 | |
| SCHEMBL3081446 | 0.83 | PTGS2 (0.59) | ACHEMAOAHSD17B1PTGS2CHRNA7 | |
| SCHEMBL424613 | 0.82 | HSD17B1 (0.54) | ACHEMAOAHSD17B1MAOBPRKCI | |
| SCHEMBL24362549 | 0.81 | HSD17B1 (0.47) | MAOAHSD17B1MAOBPRKCIMAPK14 |
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-0284359-B1 | 1,4-DISUBSTITUTED PIPERAZINE COMPOUNDS, THEIR PRODUCTION AND USE | Takeda Chemical Industries, Ltd. (JP) | 1992-01-08 | — | — | EP | disclosed |
| US-4880809-A | HYPOTENSIVE AGENTS, AMIDE DERIVATIVES | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1989-11-14 | — | — | US | disclosed |
| EP-0284359-A1 | 1,4-Disubstituted piperazine compounds, their production and use | Takeda Chemical Industries, Ltd. (JP) | 1988-09-28 | — | — | EP | disclosed |