Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 8/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.37 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | MEN1 | O00255 | 3/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | PKM | P14618 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15944431 | 0.76 | HPGD (0.42) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28023866 | 0.76 | HPGD (0.41) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28013839 | 0.75 | HPGD (0.44) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28013245 | 0.73 | KMT2A (0.45) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL28013908 | 0.72 | HPGD (0.40) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL11185069 | 0.71 | ALDH1A1 (0.43) | ALDH1A1CYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL28013836 | 0.71 | KIF11 (0.39) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 | |
| SCHEMBL6797392 | 0.70 | TSHR (0.46) | ALDH1A1HPGDKIF11MAPTKMT2A | |
| SCHEMBL1774301 | 0.70 | CYP2C19 (0.41) | ALDH1A1CYP3A4CYP2C19MAPTKMT2A | |
| SCHEMBL508028 | 0.69 | HPGD (0.44) | ALDH1A1HPGDCYP1A2CYP3A4CYP2C9 |
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-104496870-A | Catalytic synthesis method of sulfur-containing carboxylic acid compound and sulfur-containing amide compound | UNIV HUNAN | 2015-04-08 | — | — | CN | disclosed |