Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 4/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.56 |
| ▸ | HPGD | P15428 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | TSHR | P16473 | 1/20 | 0.51 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | PKM | P14618 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.50 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL14594063 | 0.89 | KMT2A (0.60) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL15870698 | 0.85 | KMT2A (0.52) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL10666782 | 0.84 | CA12 (0.58) | KMT2AALDH1A1HSD17B10MEN1CA12 | |
| SCHEMBL4403950 | 0.84 | ALDH1A1 (0.55) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL8118590 | 0.84 | ALDH1A1 (0.55) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL10671178 | 0.83 | KMT2A (0.54) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL133129 | 0.82 | ALDH1A1 (0.54) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL31065934 | 0.82 | ALDH1A1 (0.54) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL29452030 | 0.82 | ALDH1A1 (0.54) | KMT2AALDH1A1HPGDGAAHSD17B10 | |
| SCHEMBL11861092 | 0.81 | CA12 (0.63) | KMT2AALDH1A1HSD17B10MEN1CA12 |
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-114436935-A | Method for synthesizing optically active beta-aminoketone derivative by asymmetric conjugate addition | 河南师范大学 | 2022-05-06 | — | — | CN | disclosed |