Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.58 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.41 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP26A1 | O43174 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL16993556 | 0.85 | CYP3A4 (0.57) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL11069443 | 0.83 | KMT2A (0.51) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL14626670 | 0.81 | KMT2A (0.62) | KMT2APTGS1PTGS2ALDH1A1HTT | |
| SCHEMBL25836630 | 0.81 | KMT2A (0.62) | KMT2APTGS1PTGS2ALDH1A1HTT | |
| SCHEMBL16295640 | 0.80 | KMT2A (0.56) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL13900818 | 0.80 | ALDH1A1 (0.56) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL11073226 | 0.79 | KMT2A (0.60) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL9683887 | 0.79 | KMT2A (0.60) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL787390 | 0.78 | KMT2A (0.58) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 | |
| SCHEMBL7880421 | 0.78 | KMT2A (0.58) | KMT2ACYP3A4PTGS1PTGS2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111218695-B | Method for realizing ketone alpha site methylation reaction under electrochemical condition | 广西师范大学 | 2021-05-28 | — | — | CN | disclosed |
| CN-111218695-A | method for realizing ketone alpha site methylation reaction under electrochemical condition | 广西师范大学 | 2020-06-02 | — | — | CN | disclosed |