Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.63 |
| ▸ | NPC1 | O15118 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | CLK1 | P49759 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL29924865 | 1.00 | KMT2A (0.63) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL13445250 | 0.80 | ALDH1A1 (0.72) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL28619353 | 0.78 | KMT2A (1.00) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL28620179 | 0.77 | ALDH1A1 (0.43) | KMT2ANPC1ALDH1A1RAB9ASMN1; SMN2 | |
| SCHEMBL31008661 | 0.74 | P2RX7 (0.37) | KMT2ANPC1ALDH1A1RAB9ATDP1 | |
| SCHEMBL4249241 | 0.74 | RECQL (0.39) | KMT2ANPC1ALDH1A1RAB9AMEN1 | |
| SCHEMBL28675951 | 0.74 | P2RX7 (0.37) | KMT2ANPC1ALDH1A1RAB9ATDP1 | |
| SCHEMBL27844394 | 0.74 | CYP1A2 (0.41) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL22911496 | 0.74 | KMT2A (0.39) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 | |
| SCHEMBL18857080 | 0.73 | KMT2A (0.84) | KMT2ANPC1ALDH1A1CYP2C19CYP3A4 |
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-113307749-B | Method for synthesizing beta-ketosulfone derivative under mild condition and obtained beta-ketosulfone derivative | 佛山湘潭大学绿色智造研究院 | 2022-09-09 | — | — | CN | disclosed |
| CN-113307749-A | Method for synthesizing beta-ketosulfone derivative under mild condition and obtained beta-ketosulfone derivative | 佛山湘潭大学绿色智造研究院 | 2021-08-27 | — | — | CN | disclosed |