Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 4/20 | 0.38 |
| ▸ | AXL | P30530 | 1/20 | 0.35 |
| ▸ | CDK8 | P49336 | 1/20 | 0.35 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.35 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.33 |
| ▸ | JAK2 | O60674 | 2/20 | 0.33 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.33 |
| ▸ | PLK4 | O00444 | 1/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PRKCG | P05129 | 1/20 | 0.33 |
| ▸ | INSR | P06213 | 1/20 | 0.33 |
| ▸ | CDK1 | P06493 | 1/20 | 0.33 |
| ▸ | FES | P07332 | 1/20 | 0.33 |
| ▸ | IGF1R | P08069 | 1/20 | 0.33 |
| ▸ | ROS1 | P08922 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | PHKG2 | P15735 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL15241762 | 0.76 | BRD4 (0.49) | AXLCDK8TNIKDYRK1AJAK2 | |
| SCHEMBL30491442 | 0.73 | GSK3A (0.41) | AAK1KDRBRD4GSK3B | |
| SCHEMBL25305418 | 0.73 | GSK3A (0.41) | AAK1KDRBRD4GSK3B | |
| SCHEMBL28408295 | 0.73 | DYRK1A (0.44) | AXLCDK8TNIKDYRK1AJAK2 | |
| SCHEMBL1799199 | 0.71 | RPS6KA5 (0.42) | AAK1LRRK2CDK2DPYD | |
| SCHEMBL12764150 | 0.70 | CDK8 (0.57) | AAK1AXLCDK8TNIKDYRK1A | |
| SCHEMBL12764151 | 0.70 | CDK8 (0.57) | AAK1AXLCDK8TNIKLRRK2 | |
| SCHEMBL8249652 | 0.70 | MAPK8 (0.60) | AAK1AXLCDK8TNIKDYRK1A | |
| SCHEMBL12764153 | 0.69 | AXL (0.46) | AAK1AXLCDK8TNIKITK | |
| SCHEMBL12764154 | 0.69 | CDK8 (0.56) | AAK1AXLCDK8TNIKITK |
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-2023131122-A1 | FUSED RING-SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2023-07-13 | — | — | WO | disclosed |