Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 8/20 | 0.52 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.52 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | TTR | P02766 | 1/20 | 0.40 |
| ▸ | PTPRC | P08575 | 1/20 | 0.40 |
| ▸ | P4HB | P07237 | 1/20 | 0.39 |
| ▸ | MALT1 | Q9UDY8 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL23271927 | 1.00 | ESR1 (0.52) | ESR1ESR2MAOAUGT1A1MAOB | |
| SCHEMBL23271863 | 0.81 | MAOA (0.50) | MAOAMAOBMEN1NPC1ALDH1A1 | |
| SCHEMBL23271842 | 0.79 | S100A4 (0.47) | MEN1NPC1ALDH1A1MAPTRAB9A | |
| SCHEMBL9627655 | 0.77 | MEN1 (0.54) | ESR1ESR2MEN1ALDH1A1KMT2A | |
| SCHEMBL30003193 | 0.77 | MEN1 (0.54) | ESR1ESR2MEN1ALDH1A1KMT2A | |
| SCHEMBL23271815 | 0.77 | ESR2 (0.57) | ESR1ESR2MAOAUGT1A1MAOB | |
| SCHEMBL11013388 | 0.77 | ESR1 (0.57) | ESR1ESR2MAOAUGT1A1MAOB | |
| SCHEMBL30003374 | 0.77 | ESR2 (0.57) | ESR1ESR2MAOAUGT1A1MAOB | |
| SCHEMBL30004118 | 0.77 | ESR1 (0.57) | ESR1ESR2MAOAUGT1A1MAOB | |
| SCHEMBL5811756 | 0.76 | ESR2 (0.61) | ESR1ESR2MAOAUGT1A1MAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-110891980-B | Radical polymerization control agent and radical polymerization control method | 川崎化成工业株式会社 | 2022-09-30 | — | — | CN | disclosed |