Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.40 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.40 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | BAZ1A | Q9NRL2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CASP1 | P29466 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL27624729 | 0.95 | MAPT (0.41) | HSP90AA1HSP90AB1SLC22A12PDE10AALDH1A1 | |
| SCHEMBL3173449 | 0.79 | MAPT (0.52) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT | |
| SCHEMBL3173460 | 0.79 | MAPT (0.52) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT | |
| SCHEMBL3174017 | 0.77 | MAPT (0.52) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT | |
| SCHEMBL3174004 | 0.77 | MAPT (0.52) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT | |
| SCHEMBL8001971 | 0.74 | ALDH1A1 (0.58) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT | |
| SCHEMBL3164630 | 0.70 | ERN1 (0.48) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT | |
| SCHEMBL28062567 | 0.69 | RAB9A (0.51) | ALDH1A1MAPTL3MBTL1CYP1A2RAB9A | |
| SCHEMBL358428 | 0.69 | HSP90AA1 (0.55) | HSP90AA1HSP90AB1SLC22A12PDE10AALDH1A1 | |
| SCHEMBL30918543 | 0.69 | PDE10A (0.50) | HSP90AA1HSP90AB1PDE10AALDH1A1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-101570517-A | 1- (4-benzyl-piperazin-1-yl) -3-phenyl-propenone derivatives | NOVARTIS AG (CH) | 2009-11-04 | — | — | CN | disclosed |
| CN-100554257-C | 1- (4-benzyl-piperazin-1-yl) -3-phenyl-propenone derivatives | NOVARTIS AG (CH) | 2009-10-28 | — | — | CN | disclosed |
| CN-1708489-A | 1- (4-benzyl-piperazin-1-yl) -3-phenyl-propenone derivatives | NOVARTIS AG (CH) | 2005-12-14 | — | — | CN | disclosed |