Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 11/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.38 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL25003079 | 0.76 | MEN1 (0.66) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL27757618 | 0.70 | PDE4B (0.48) | PDE4BPDE4D | |
| SCHEMBL28686898 | 0.68 | SMN1; SMN2 (0.62) | ALDH1A1MEN1KMT2AMAPK1SMN1; SMN2 | |
| SCHEMBL25523013 | 0.67 | PDE4B (0.42) | ALDH1A1MEN1KMT2ALMNAKDM4E | |
| SCHEMBL10897934 | 0.66 | MEN1 (0.67) | MEN1KMT2ACHRNA7TDP1PDE4B | |
| SCHEMBL27831457 | 0.66 | HDAC1 (0.69) | ALDH1A1MAPK1SMN1; SMN2TDP1HDAC3 | |
| SCHEMBL5674267 | 0.66 | HDAC1 (0.75) | ALDH1A1MAPK1SMN1; SMN2TDP1HDAC3 | |
| SCHEMBL10980676 | 0.65 | MEN1 (0.50) | MEN1KMT2ACHRNA7TDP1PDE4B | |
| Phenylbutanoic Acid SCHEMBL5322401 | 0.64 | HDAC1 (0.72) | MAPK1SMN1; SMN2LMNATDP1HDAC3 | |
| SCHEMBL16375967 | 0.64 | NAAA (0.56) | TNKS2MAPK1SMN1; SMN2TP53HDAC3 |
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-101423502-A | 1-heterocycle-5-phenyl-2amylene-1-ones compounds as well as preparation method and application thereof | UNIV CHINA AGRICULTURAL (CN) | 2009-05-06 | — | — | CN | disclosed |