Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 4/20 | 0.45 |
| ▸ | CYP1B1 | Q16678 | 4/20 | 0.45 |
| ▸ | GPR183 | P32249 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28819259 | 0.92 | GPR183 (0.44) | CYP1A1CYP1B1GPR183MEN1MAPT | |
| SCHEMBL28819227 | 0.86 | L3MBTL1 (0.55) | CYP1A1CYP1B1GPR183MEN1MAPT | |
| SCHEMBL28819248 | 0.85 | ALDH1A1 (0.43) | GPR183MEN1MAPTKMT2ALMNA | |
| SCHEMBL28819260 | 0.84 | PKM (0.53) | CYP1A1CYP1B1GPR183MEN1MAPT | |
| SCHEMBL28819245 | 0.80 | LMNA (0.52) | GPR183MEN1MAPTKMT2ALMNA | |
| SCHEMBL28819241 | 0.80 | LMNA (0.48) | GPR183LMNASMN1; SMN2L3MBTL1ALDH1A1 | |
| SCHEMBL28819261 | 0.76 | GPR183 (0.52) | GPR183MEN1MAPTKMT2ALMNA | |
| SCHEMBL28819231 | 0.75 | GPR183 (0.62) | GPR183LMNAL3MBTL1ALDH1A1 | |
| SCHEMBL28819236 | 0.73 | GPR183 (0.62) | GPR183MEN1MAPTKMT2ALMNA | |
| SCHEMBL28819256 | 0.73 | PKM (0.67) | GPR183MEN1MAPTKMT2ALMNA |
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-114634465-A | Sulfonyl piperazine-containing pentadiene ketone derivative and preparation method and application thereof | 贵州大学 | 2022-06-17 | — | — | CN | disclosed |