Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | CES1 | P23141 | 3/20 | 0.46 |
| ▸ | CES2 | O00748 | 2/20 | 0.46 |
| ▸ | MAOB | P27338 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Acetophenone SCHEMBL28919004 | 0.98 | SMN1; SMN2 (0.56) | SMN1; SMN2MAPTLMNAHPGDALDH1A1 | |
| Acetophenone SCHEMBL6482494 | 0.86 | MAPT (0.68) | SMN1; SMN2MAPTLMNAHPGDALDH1A1 | |
| Acetophenone SCHEMBL27759678 | 0.84 | MAPT (0.65) | SMN1; SMN2MAPTLMNAHPGDALDH1A1 | |
| Acetophenone SCHEMBL16745259 | 0.83 | — | — | |
| Acetophenone SCHEMBL30537005 | 0.83 | — | — | |
| Acetophenone SCHEMBL27462873 | 0.83 | MAPT (0.71) | SMN1; SMN2MAPTLMNAHPGDALDH1A1 | |
| Acetophenone SCHEMBL1450855 | 0.83 | — | — | |
| Acetophenone SCHEMBL30537000 | 0.83 | — | — | |
| Acetophenone SCHEMBL737 | 0.83 | — | — | |
| Acetophenone SCHEMBL719033 | 0.83 | MAPT (0.71) | SMN1; SMN2MAPTLMNAHPGDALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104072439-A | Halogen-substituted four nitrogen azole acetophenone compound,preparation method and application thereof | ZHANG YUANQIANG | 2014-10-01 | — | — | CN | disclosed |
| CN-104072439-A | Halogen-substituted four nitrogen azole acetophenone compound,preparation method and application thereof | ZHANG YUANQIANG | 2014-10-01 | — | — | CN | disclosed |