Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRAF | P15056 | 6/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | CDK8 | P49336 | 1/20 | 0.45 |
| ▸ | CLK2 | P49760 | 1/20 | 0.45 |
| ▸ | CDK7 | P50613 | 1/20 | 0.45 |
| ▸ | CDK9 | P50750 | 1/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.45 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.45 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.45 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.45 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.45 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.43 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.43 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.43 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL22130148 | 0.83 | KDM4E (0.59) | KDM4ENSD2ALDH1A1MAPTPIK3CD | |
| SCHEMBL6618268 | 0.81 | KDM4E (0.43) | KDM4ENSD2ALDH1A1MAPTBACE1 | |
| SCHEMBL29303290 | 0.80 | KDM4E (0.42) | KDM4ENSD2ALDH1A1MAPTBACE1 | |
| SCHEMBL22926317 | 0.79 | KDM4E (0.41) | DYRK1ACLK2CLK4DYRK1BKDM4E | |
| SCHEMBL27914445 | 0.79 | BACE1 (0.41) | KDM4ENSD2ALDH1A1MAPTBACE1 | |
| SCHEMBL23813576 | 0.78 | MAOB (0.38) | BRAFDYRK1AMAP4K4CDK8CLK2 | |
| SCHEMBL8791483 | 0.76 | KDM4E (0.55) | KDM4EMAPK14NSD2ALDH1A1MAPT | |
| SCHEMBL16595983 | 0.75 | MAOA (0.46) | KDM4EBACE1CHRM1 | |
| SCHEMBL21068988 | 0.74 | KDM4E (0.40) | KDM4ENSD2ALDH1A1MAPTBACE1 | |
| SCHEMBL20582309 | 0.74 | KDM4E (0.41) | BRAFKDM4ENSD2ALDH1A1MAPT |
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-102675286-B | Indazole compounds, preparation method, application and pharmaceutical composition thereof | SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) | 2015-08-19 | — | — | CN | disclosed |