Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP1 | P53582 | 2/20 | 0.43 |
| ▸ | PGR | P06401 | 2/20 | 0.42 |
| ▸ | PPOX | P50336 | 1/20 | 0.41 |
| ▸ | S100A4 | P26447 | 1/20 | 0.41 |
| ▸ | SRD5A1 | P18405 | 4/20 | 0.41 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 2/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | DRD4 | P21917 | 2/20 | 0.40 |
| ▸ | HTR2A | P28223 | 2/20 | 0.40 |
| ▸ | HTR2C | P28335 | 2/20 | 0.40 |
| ▸ | HTR7 | P34969 | 2/20 | 0.40 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.38 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | CMA1 | P23946 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL14430319 | 1.00 | METAP1 (0.43) | METAP1PGRPPOXS100A4SRD5A1 | |
| SCHEMBL2352750 | 0.85 | F7 (0.42) | METAP1PGRPPOXS100A4SRD5A1 | |
| SCHEMBL29834923 | 0.82 | MAOB (0.48) | CES1MEN1KMT2A | |
| SCHEMBL29405349 | 0.82 | METAP1 (0.41) | METAP1PGRPPOXS100A4SRD5A1 | |
| SCHEMBL6251847 | 0.82 | METAP1 (0.41) | METAP1PGRPPOXS100A4SRD5A1 | |
| SCHEMBL9587877 | 0.82 | HTR2A (0.46) | METAP1PPOXS100A4SRD5A1AHR | |
| SCHEMBL3959283 | 0.81 | ESR2 (0.51) | — | |
| SCHEMBL9156893 | 0.80 | METAP1 (0.39) | METAP1PGRPPOXS100A4SRD5A1 | |
| SCHEMBL12310527 | 0.79 | METAP1 (0.44) | METAP1PGRSRD5A1GRM1MEN1 | |
| SCHEMBL4950145 | 0.78 | SRD5A1 (0.43) | METAP1PPOXSRD5A1HTR1ADRD2 |
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-114262250-A | Synthetic method of aromatic ring benzyl ortho-position dialkyl | 乐威医药（江苏）股份有限公司 | 2022-04-01 | — | — | CN | disclosed |