Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.43 |
| ▸ | MME | P08473 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 1/20 | 0.41 |
| ▸ | CA4 | P22748 | 1/20 | 0.41 |
| ▸ | CA6 | P23280 | 1/20 | 0.41 |
| ▸ | CA5A | P35218 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.41 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 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 | |
|---|---|---|---|---|
| SCHEMBL28020080 | 1.00 | KMT2A (0.48) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28820145 | 0.85 | KMT2A (0.46) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28820146 | 0.85 | KMT2A (0.46) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28020416 | 0.83 | PPID (0.50) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28020411 | 0.83 | PPID (0.50) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28019981 | 0.82 | CYP2C9 (0.50) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28019983 | 0.82 | CYP2C9 (0.50) | KMT2ACYP2D6ALDH1A1MAPTMEN1 | |
| SCHEMBL28020429 | 0.82 | LMNA (0.45) | KMT2AALDH1A1HPGDTP53CA12 | |
| SCHEMBL28020432 | 0.82 | LMNA (0.45) | KMT2AALDH1A1HPGDTP53CA12 | |
| SCHEMBL19500095 | 0.77 | KMT2A (0.61) | KMT2AALDH1A1MAPTMEN1TSHR |
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-103910644-B | Beta-enaminone ester compounds, and synthesis method and application of beta-enaminone ester compounds | UNIV GUANGXI NORMAL | 2015-06-24 | — | — | CN | disclosed |