Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.51 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | MAOA | P21397 | 9/20 | 0.43 |
| ▸ | MAOB | P27338 | 9/20 | 0.43 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.43 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.43 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.43 |
| ▸ | PDE4A | P27815 | 1/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.43 |
| ▸ | PRKCI | P41743 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL3082824 | 0.89 | ACHE (0.54) | ACHEHSD17B1KMT2AMAOBABCC4 | |
| SCHEMBL9621241 | 0.87 | HSD17B1 (0.45) | HSD17B1MEN1MAPK1KMT2ANPSR1 | |
| SCHEMBL424613 | 0.80 | HSD17B1 (0.54) | ACHEHSD17B1MEN1MAPK1KMT2A | |
| SCHEMBL17043164 | 0.80 | ACHE (0.42) | ACHEHSD17B1KMT2AMAOBABCC4 | |
| SCHEMBL19573418 | 0.78 | MAOB (0.37) | ACHEHSD17B1MEN1MAPK1KMT2A | |
| SCHEMBL1545212 | 0.77 | HSD17B1 (0.46) | ACHEHSD17B1MEN1MAPK1KMT2A | |
| SCHEMBL8712272 | 0.77 | HSD17B1 (0.46) | ACHEHSD17B1MEN1MAPK1KMT2A | |
| SCHEMBL2912990 | 0.77 | MAPT (0.48) | ACHEMAPK1ABCC4ABCB11CHRM2 | |
| SCHEMBL3083342 | 0.77 | HSD17B1 (0.46) | ACHEHSD17B1MEN1KMT2AMAOA | |
| SCHEMBL30701777 | 0.77 | HTR2A (0.43) | ACHEHSD17B1MEN1KMT2AABCC4 |
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 |
| CN-88101588-A | Preparation 1, the method for 4-disubstituted piperazines compounds | — | 1988-11-23 | — | — | CN | disclosed |