Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.59 |
| ▸ | MAPT | P10636 | 2/20 | 0.59 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | RECQL | P46063 | 1/20 | 0.57 |
| ▸ | CES2 | O00748 | 1/20 | 0.53 |
| ▸ | CES1 | P23141 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.53 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5956218 | 0.89 | HDAC1 (0.58) | ALDH1A1MAPTHPGDCYP2C19RECQL | |
| SCHEMBL10696227 | 0.87 | HDAC8 (0.60) | ALDH1A1MAPTHPGDCES2CES1 | |
| SCHEMBL5131381 | 0.86 | HDAC8 (0.63) | ALDH1A1CES2CES1HDAC3HDAC4 | |
| SCHEMBL6846903 | 0.84 | MAPT (0.56) | ALDH1A1MAPTHPGDCES2CES1 | |
| SCHEMBL9666703 | 0.82 | L3MBTL1 (0.59) | ALDH1A1MAPTHDAC3HDAC4HDAC1 | |
| SCHEMBL4073022 | 0.80 | ALDH1A1 (0.54) | ALDH1A1MAPTHPGDCYP2C19RECQL | |
| SCHEMBL18940552 | 0.80 | ALDH1A1 (0.54) | ALDH1A1MAPTHPGDCYP2C19RECQL | |
| SCHEMBL9888 | 0.80 | ALDH1A1 (0.86) | ALDH1A1MAPTHPGDCYP2C19RECQL | |
| Hydrochloric Acid SCHEMBL23062930 | 0.78 | ALDH1A1 (0.83) | ALDH1A1MAPTHPGDCYP2C19RECQL | |
| SCHEMBL11658250 | 0.78 | ALDH1A1 (0.83) | ALDH1A1MAPTHPGDCYP2C19RECQL |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106008251-A | Preparation method of 2-benzylidene isobutyryl acetanilide | 河南豫辰药业股份有限公司 | 2016-10-12 | — | — | CN | disclosed |
| EP-1200393-B1 | OXIME AMIDES AND HYDRAZONE AMIDES HAVING FUNGICIDAL ACTIVITY | MONSANTO TECHNOLOGY LLC (US) | 2003-12-10 | — | — | EP | disclosed |
| EP-1200393-A1 | OXIME AMIDES AND HYDRAZONE AMIDES HAVING FUNGICIDAL ACTIVITY | Monsanto Technology LLC (US) | 2002-05-02 | — | — | EP | disclosed |
| WO-2001012590-A1 | OXYME AMIDES AND HYDRAZONE AMIDES HAVING FUNGICIDAL ACTIVITY | MONSANTO TECHNOLOGY LLC (US) | 2001-02-22 | — | — | WO | disclosed |