Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 3/20 | 0.34 |
| ▸ | PDE4A | P27815 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | EHMT2 | Q96KQ7 | 5/20 | 0.33 |
| ▸ | NSD2 | O96028 | 4/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | HTR2C | P28335 | 1/20 | 0.33 |
| ▸ | HTR7 | P34969 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | WEE2 | P0C1S8 | 1/20 | 0.32 |
| ▸ | WEE1 | P30291 | 1/20 | 0.32 |
| ▸ | PKMYT1 | Q99640 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | EGFR | P00533 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7447093 | 1.00 | CHEK1 (0.34) | CHEK1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7447087 | 1.00 | CHEK1 (0.34) | CHEK1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7393752 | 0.95 | EHMT2 (0.35) | CHEK1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7393757 | 0.95 | EHMT2 (0.35) | CHEK1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7444417 | 0.95 | EHMT2 (0.35) | CHEK1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL7403386 | 0.94 | EHMT2 (0.36) | CHEK1EHMT2NSD2HTR1A | |
| SCHEMBL7403389 | 0.94 | EHMT2 (0.36) | CHEK1EHMT2NSD2HTR1A | |
| SCHEMBL7445293 | 0.94 | EHMT2 (0.36) | CHEK1EHMT2NSD2HTR1A | |
| SCHEMBL7400404 | 0.92 | CHEK1 (0.37) | CHEK1NSD2 | |
| SCHEMBL7400407 | 0.92 | CHEK1 (0.37) | CHEK1NSD2 |
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-2001064648-A1 | ISOQUINOLINE DERIVATIVES | SANOFI-SYNTHELABO (FR) | 2001-09-07 | — | — | WO | disclosed |