Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | CHEK2 | O96017 | 8/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 7/20 | 0.32 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.32 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.32 |
| ▸ | CASP1 | P29466 | 2/20 | 0.32 |
| ▸ | CASP7 | P55210 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | DRD2 | P14416 | 2/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.31 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.31 |
| ▸ | HTR3A | P46098 | 1/20 | 0.31 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | INSR | P06213 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 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 | |
|---|---|---|---|---|
| SCHEMBL20673865 | 0.81 | CHEK2 (0.35) | CHEK2CHEK1CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL21959627 | 0.76 | ELANE (0.33) | ELANEAURKAINSRCDK1PDGFRB | |
| SCHEMBL23937773 | 0.76 | BRD9 (0.33) | — | |
| SCHEMBL21959623 | 0.73 | PDE10A (0.32) | CHEK2CHEK1CYP11B1CYP11B2ALDH1A1 | |
| SCHEMBL23937881 | 0.73 | PARP1 (0.37) | DRD2SLC6A4KCNH2AURKAINSR | |
| SCHEMBL23937732 | 0.72 | CYP11B1 (0.36) | CYP11B1CYP11B2DRD2SLC6A4PIP4K2A | |
| SCHEMBL21958686 | 0.70 | DRD2 (0.37) | CYP11B1CYP11B2DRD2SLC6A4 | |
| SCHEMBL24995507 | 0.67 | PDE10A (0.31) | — | |
| SCHEMBL23442191 | 0.65 | CHEK2 (0.50) | CHEK2CHEK1ALDH1A1CYP1A2CASP1 | |
| SCHEMBL16167705 | 0.65 | CNR2 (0.38) | ALDH1A1CYP1A2CASP1CASP7HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |