Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAP4K4 | O95819 | 3/20 | 0.50 |
| ▸ | PIK3CA | P42336 | 5/20 | 0.46 |
| ▸ | PIK3CD | O00329 | 2/20 | 0.46 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.46 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.46 |
| ▸ | PIP5K1C | O60331 | 1/20 | 0.46 |
| ▸ | PI4KA | P42356 | 1/20 | 0.46 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.46 |
| ▸ | JAK2 | O60674 | 1/20 | 0.44 |
| ▸ | AAK1 | Q2M2I8 | 7/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.41 |
| ▸ | BMP2K | Q9NSY1 | 1/20 | 0.41 |
| ▸ | PDPK1 | O15530 | 2/20 | 0.41 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | CLK2 | P49760 | 1/20 | 0.40 |
| ▸ | CDK7 | P50613 | 1/20 | 0.40 |
| ▸ | CDK9 | P50750 | 1/20 | 0.40 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1857081 | 0.75 | ACHE (0.49) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL4353977 | 0.72 | MAP4K4 (0.48) | MAP4K4PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL29023207 | 0.72 | ACHE (0.65) | CDK9 | |
| SCHEMBL30398246 | 0.72 | ACHE (0.65) | CDK9 | |
| SCHEMBL16974250 | 0.71 | PDGFRB (0.49) | MAP4K4PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL19219068 | 0.71 | MAPT (0.47) | KDM4EMEN1ALDH1A1LMNAMAPT | |
| SCHEMBL16974229 | 0.71 | PIK3CA (0.44) | MAP4K4PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL3332604 | 0.71 | AAK1 (0.44) | MAP4K4PIK3CAPIK3CDPIK3CBPIK3CG | |
| Ammonia Solution, Strong SCHEMBL28083832 | 0.70 | DYRK1A (0.49) | MAP4K4PIK3CAPIK3CDPIK3CBPIK3CG | |
| SCHEMBL12575926 | 0.70 | HSP90AB1 (0.55) | PIK3CADYRK1AKDM4EMEN1ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106132951-B | quinoline-based kinase inhibitors | 百时美施贵宝公司 | 2019-02-12 | — | — | CN | claimed |
| CN-106132951-B | quinoline-based kinase inhibitors | 百时美施贵宝公司 | 2019-02-12 | — | — | CN | disclosed |