Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HTR3A | P46098 | 3/20 | 0.33 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | NTMT1 | Q9BV86 | 1/20 | 0.31 |
| ▸ | ALPI | P09923 | 1/20 | 0.31 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.31 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.31 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5226514 | 0.85 | PTGS1 (0.38) | GAASMN1; SMN2PTGS1CYP3A4CYP2D6 | |
| SCHEMBL5229163 | 0.83 | USP2 (0.39) | SMN1; SMN2PTGS1CYP3A4CYP2D6MAPT | |
| SCHEMBL5226654 | 0.79 | BCHE (0.41) | MEN1KMT2AGAASMN1; SMN2CYP3A4 | |
| SCHEMBL7256585 | 0.79 | GAA (0.44) | MEN1KMT2AGAASMN1; SMN2HTR3A | |
| SCHEMBL13019206 | 0.77 | PTGS1 (0.43) | GAASMN1; SMN2PTGS1CYP3A4CYP2D6 | |
| SCHEMBL5224047 | 0.77 | KDM4E (0.45) | SMN1; SMN2PTGS1CYP3A4CYP2D6MAPT | |
| SCHEMBL5224632 | 0.75 | ALDH1A1 (0.39) | MEN1KMT2AGAASMN1; SMN2PTGS1 | |
| SCHEMBL5225875 | 0.74 | CYP2D6 (0.36) | SMN1; SMN2PTGS1CYP3A4CYP2D6MAPT | |
| SCHEMBL5228002 | 0.74 | TSHR (0.39) | KMT2ASMN1; SMN2PTGS1ALDH1A1TP53 | |
| SCHEMBL5224886 | 0.74 | PTGS1 (0.37) | MEN1KMT2AGAASMN1; SMN2PTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |