Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 2/20 | 0.42 |
| ▸ | ERCC5 | P28715 | 1/20 | 0.37 |
| ▸ | FEN1 | P39748 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.33 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.33 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.33 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.33 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.33 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.33 |
| ▸ | JAK1 | P23458 | 1/20 | 0.33 |
| ▸ | TNKS | O95271 | 1/20 | 0.31 |
| ▸ | PARP1 | P09874 | 1/20 | 0.31 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.31 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.31 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL12617155 | 0.72 | ADORA2A (0.35) | PDPK1DYRK1A | |
| SCHEMBL13764548 | 0.69 | PDPK1 (0.44) | PDPK1ERCC5FEN1GRIN2DGRIN3B | |
| SCHEMBL24000490 | 0.68 | GRIN2D (0.43) | PDPK1DYRK1AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL14826495 | 0.67 | ADORA2A (0.42) | PDPK1DYRK1AGRIN2DGRIN3BGRIN1 | |
| SCHEMBL20229834 | 0.67 | ADORA2A (0.55) | PDPK1PARP1ADORA1 | |
| SCHEMBL25170501 | 0.67 | PDPK1 (0.54) | PDPK1ERCC5FEN1TNKSPARP1 | |
| SCHEMBL25331496 | 0.67 | ADORA2A (0.47) | PDPK1DYRK1ATNKSPARP1TNKS2 | |
| SCHEMBL1463831 | 0.66 | PDPK1 (0.41) | PDPK1ERCC5FEN1 | |
| SCHEMBL18639718 | 0.64 | PDPK1 (0.40) | PDPK1ERCC5FEN1GRIN2DGRIN3B | |
| SCHEMBL25332682 | 0.64 | PDPK1 (0.34) | PDPK1DYRK1A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020239076-A1 | PYRIDAZINONE DERIVATIVES AS THYROXINE RECEPTOR-Β AGONISTS AND APPLICATION THEREOF | 南京明德新药研发有限公司 | 2020-12-03 | — | — | WO | disclosed |