Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 1/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.47 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.46 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.46 |
| ▸ | CDK2 | P24941 | 1/20 | 0.46 |
| ▸ | CDK9 | P50750 | 1/20 | 0.46 |
| ▸ | AXL | P30530 | 1/20 | 0.46 |
| ▸ | PRKCI | P41743 | 1/20 | 0.46 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.42 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.42 |
| ▸ | CCNC | P24863 | 2/20 | 0.40 |
| ▸ | CDK8 | P49336 | 2/20 | 0.40 |
| ▸ | MAPKAPK2 | P49137 | 2/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.37 |
| ▸ | TEK | Q02763 | 2/20 | 0.37 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 1/20 | 0.37 |
| ▸ | EGFR | P00533 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | INSR | P06213 | 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 | |
|---|---|---|---|---|
| SCHEMBL28596883 | 1.00 | CLK1 (0.47) | CLK1DYRK1ACCNT1CCNA2CDK2 | |
| SCHEMBL10125408 | 0.83 | CCNK (0.44) | CLK1DYRK1ACCNT1CCNA2CDK2 | |
| SCHEMBL101422 | 0.81 | CDK9 (0.54) | CLK1DYRK1ACCNT1CCNA2CDK2 | |
| SCHEMBL30173340 | 0.76 | AXL (0.46) | AXLPRKCINUDT1KDRGSK3B | |
| SCHEMBL28598977 | 0.76 | AXL (0.46) | AXLPRKCINUDT1KDRGSK3B | |
| SCHEMBL30173290 | 0.76 | PRKCI (0.51) | CLK1DYRK1ACDK9AXLPRKCI | |
| SCHEMBL28603791 | 0.76 | PRKCI (0.51) | CLK1DYRK1ACDK9AXLPRKCI | |
| SCHEMBL30173284 | 0.75 | AXL (0.58) | AXLPRKCINUDT1AURKBAURKA | |
| SCHEMBL28602403 | 0.75 | AXL (0.58) | AXLPRKCINUDT1AURKBAURKA | |
| SCHEMBL30173289 | 0.75 | PRKCI (0.50) | DYRK1ACDK9AXLPRKCIPRKCQ |
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-113200983-B | Compound with pyrrolopyridine structure, preparation method and medical application | 中国药科大学 | 2023-01-03 | — | — | CN | disclosed |