Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.40 |
| ▸ | BCR | P11274 | 1/20 | 0.40 |
| ▸ | FABP1 | P07148 | 1/20 | 0.39 |
| ▸ | MKNK1 | Q9BUB5 | 2/20 | 0.39 |
| ▸ | MKNK2 | Q9HBH9 | 2/20 | 0.39 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 2/20 | 0.38 |
| ▸ | USP7 | Q93009 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | ALDH5A1 | P51649 | 1/20 | 0.38 |
| ▸ | ABAT | P80404 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 4/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2083077 | 0.83 | ALDH1A1 (0.42) | ABL1TDP1MEN1KMT2A | |
| SCHEMBL30069637 | 0.82 | NFE2L2 (0.42) | FABP1MKNK1MKNK2NPC1RAB9A | |
| SCHEMBL10119498 | 0.82 | TDP1 (0.47) | TDP1KDM4ENPC1RAB9AL3MBTL1 | |
| SCHEMBL2083783 | 0.82 | COMT (0.44) | MKNK1MKNK2TDP1KDM4EMEN1 | |
| SCHEMBL28335272 | 0.82 | TRIM24 (0.43) | ABL1MKNK1MKNK2TDP1KDM4E | |
| SCHEMBL24742077 | 0.82 | NFE2L2 (0.42) | FABP1MKNK1MKNK2NPC1RAB9A | |
| SCHEMBL11624905 | 0.81 | APP (0.52) | ERN1KDM4EMEN1NPC1HSP90AA1 | |
| SCHEMBL8512088 | 0.80 | S100A4 (0.45) | ABL1TDP1ERN1KDM4EMEN1 | |
| Bromide SCHEMBL11620846 | 0.80 | APP (0.50) | ERN1KDM4EMEN1NPC1HSP90AA1 | |
| SCHEMBL2082335 | 0.79 | CYP2A6 (0.50) | MKNK1MKNK2ERN1KDM4E |
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-114436946-A | Impurity in sodium picosulfate intermediate and preparation method thereof | 海南鑫开源医药科技有限公司 | 2022-05-06 | — | — | CN | disclosed |