Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | LMNA | P02545 | 4/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL28132837 | 0.75 | KDM4E (0.42) | ALDH1A1LMNATSHRHSD17B10KDM4E | |
| SCHEMBL30935952 | 0.75 | LOXL2 (0.41) | ALDH1A1LMNAL3MBTL1HSD17B10KDM4E | |
| SCHEMBL22350534 | 0.74 | KDM4E (0.45) | ALDH1A1LMNATSHRNPSR1MAPK14 | |
| SCHEMBL25308830 | 0.74 | CA1 (0.43) | ALDH1A1LMNATSHRHSD17B10KDM4E | |
| SCHEMBL31416652 | 0.71 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRNPSR1L3MBTL1 | |
| SCHEMBL30159532 | 0.69 | ALDH1A1 (0.47) | ALDH1A1LMNAL3MBTL1HSD17B10KDM4E | |
| SCHEMBL24849951 | 0.69 | ALDH1A1 (0.47) | ALDH1A1LMNAL3MBTL1HSD17B10KDM4E | |
| SCHEMBL4142698 | 0.69 | KDM4E (0.47) | ALDH1A1LMNATSHRNPSR1L3MBTL1 | |
| SCHEMBL24485756 | 0.69 | CNR2 (0.46) | ALDH1A1KDM4EMEN1KMT2ATP53 | |
| SCHEMBL1504529 | 0.68 | ALDH1A1 (0.46) | ALDH1A1LMNATSHRMAPK14L3MBTL1 |
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-105384754-B | Heterocycle compound as kinases inhibitor and its preparation method and application | 上海科州药物研发有限公司 | 2018-04-20 | — | — | CN | disclosed |