Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | CASP1 | P29466 | 1/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | APAF1 | O14727 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | NCF1 | P14598 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28821268 | 0.86 | NCF1 (0.50) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL7371735 | 0.82 | MAPT (0.45) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL14267953 | 0.80 | MAPT (0.52) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL10289916 | 0.80 | MAPT (0.52) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL17066275 | 0.77 | GPR3 (0.47) | MAPTKDM4ECYP1A2CYP3A4LMNA | |
| SCHEMBL4726688 | 0.76 | ALDH1A1 (0.55) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL11233631 | 0.76 | MAPT (0.48) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL17626289 | 0.76 | MAPT (0.47) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL14258114 | 0.76 | MAPT (0.47) | MAPTKDM4EALDH1A1ALOX15MAPK1 | |
| SCHEMBL21652634 | 0.74 | ALDH1A1 (0.78) | MAPTKDM4EALDH1A1ALOX15MAPK1 |
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-111454252-A | Aromatic ring/aromatic heterocycle-triazole-methylene-TCP derivative and preparation method and application thereof | 郑州大学 | 2020-07-28 | — | — | CN | disclosed |