Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | IDO1 | P14902 | 2/20 | 0.33 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.33 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.33 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | METAP1 | P53582 | 1/20 | 0.32 |
| ▸ | NAMPT | P43490 | 1/20 | 0.32 |
| ▸ | GPR139 | Q6DWJ6 | 1/20 | 0.32 |
| ▸ | SCD | O00767 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | SRC | P12931 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL18209904 | 0.82 | CNR2 (0.37) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL2173526 | 0.74 | MAPK1 (0.41) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL24255779 | 0.73 | GSK3B (0.37) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL18283999 | 0.72 | CYP17A1 (0.39) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL22322779 | 0.72 | CNR2 (0.40) | GSK3BDYRK1ACNR2BRD9CYP17A1 | |
| SCHEMBL22952416 | 0.72 | GSK3B (0.39) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL23009294 | 0.72 | ATR (0.40) | GSK3BDYRK1AIDO1BRD9HDAC3 | |
| SCHEMBL18366036 | 0.72 | GSK3B (0.39) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL25833918 | 0.71 | CNR2 (0.38) | GSK3BDYRK1ACNR2IDO1BRD9 | |
| SCHEMBL21164202 | 0.70 | GSK3B (0.37) | GSK3BDYRK1ACNR2IDO1BRD9 |
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-107646036-A | Pyrazole derivatives useful as inhibitors of 5-lipoxygenase activating protein (F L AP) | 阿斯利康(瑞典)有限公司 | 2018-01-30 | — | — | CN | disclosed |