Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 8/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.38 |
| ▸ | APEX1 | P27695 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | S100A4 | P26447 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.34 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL14135112 | 0.80 | PDK2 (0.39) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL15108313 | 0.78 | MAPT (0.43) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL20752425 | 0.76 | PDK2 (0.37) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL3633870 | 0.74 | THRB (0.48) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL18879390 | 0.73 | PDK2 (0.48) | PDK2THRBTDP1ALDH1A1APEX1 | |
| SCHEMBL23936830 | 0.72 | PDK2 (0.52) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL2239449 | 0.72 | PDK2 (0.52) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL30341830 | 0.72 | PDK2 (0.52) | PDK2THRBTDP1ESR1ESR2 | |
| SCHEMBL6154693 | 0.71 | MAPT (0.46) | PDK2THRBTDP1ALDH1A1MAPT | |
| SCHEMBL11688916 | 0.71 | ESR1 (0.37) | PDK2THRBTDP1ESR1ESR2 |
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-108273478-B | Formaldehyde removal composition and product | 李怀玉 | 2021-03-02 | — | — | CN | disclosed |