Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 6/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.56 |
| ▸ | MEN1 | O00255 | 4/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.55 |
| ▸ | GAA | P10253 | 4/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | DRD3 | P35462 | 1/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.55 |
| ▸ | RECQL | P46063 | 1/20 | 0.55 |
| ▸ | APP | P05067 | 6/20 | 0.54 |
| ▸ | MAOA | P21397 | 4/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL4662954 | 0.94 | MAPT (0.59) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL13105388 | 0.92 | MEN1 (0.48) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL4664881 | 0.88 | MAPT (0.62) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL13107030 | 0.87 | TRPV1 (0.52) | KDM4E | |
| SCHEMBL179128 | 0.82 | MAPT (0.66) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL30425269 | 0.81 | MAPT (0.68) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL4661832 | 0.79 | APP (0.62) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL4664693 | 0.78 | APP (0.64) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL4663098 | 0.78 | MAPT (0.64) | MAPTALDH1A1KMT2AMEN1TDP1 | |
| SCHEMBL4662914 | 0.78 | MAPT (0.56) | MAPTALDH1A1KMT2AMEN1TDP1 |
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-116924990-A | Isotope-labeled-based 1- (4-esterphenyl) -3-methyl-5-pyrazolone reagent and synthetic method and application thereof | 郑州大学 | 2023-10-24 | — | — | CN | disclosed |