Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKB | Q96GD4 | 5/20 | 0.84 |
| ▸ | FLT1 | P17948 | 4/20 | 0.84 |
| ▸ | MET | P08581 | 14/20 | 0.83 |
| ▸ | AXL | P30530 | 6/20 | 0.83 |
| ▸ | KDR | P35968 | 6/20 | 0.83 |
| ▸ | MERTK | Q12866 | 4/20 | 0.73 |
| ▸ | FLT3 | P36888 | 4/20 | 0.69 |
| ▸ | RET | P07949 | 3/20 | 0.69 |
| ▸ | KIT | P10721 | 3/20 | 0.69 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.69 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.69 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.69 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.69 |
| ▸ | AURKA | O14965 | 2/20 | 0.67 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.67 |
| ▸ | ABL1 | P00519 | 2/20 | 0.67 |
| ▸ | EGFR | P00533 | 2/20 | 0.67 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.67 |
| ▸ | NTRK1 | P04629 | 2/20 | 0.67 |
| ▸ | LCK | P06239 | 2/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL16070037 | 0.91 | AURKB (1.00) | AURKBFLT1METAXLKDR | |
| Exelixis SCHEMBL371899 | 0.91 | MET (1.00) | AURKBFLT1METAXLKDR | |
| Exelixis SCHEMBL29693473 | 0.91 | MET (1.00) | AURKBFLT1METAXLKDR | |
| SCHEMBL19373358 | 0.90 | MET (0.88) | AURKBFLT1METAXLKDR | |
| SCHEMBL16069980 | 0.89 | MET (0.82) | AURKBFLT1METAXLKDR | |
| SCHEMBL21299311 | 0.89 | MET (0.79) | AURKBFLT1METAXLKDR | |
| SCHEMBL4401190 | 0.89 | AXL (0.88) | AURKBFLT1METAXLKDR | |
| SCHEMBL29693431 | 0.89 | AXL (0.88) | AURKBFLT1METAXLKDR | |
| SCHEMBL372296 | 0.89 | AXL (0.88) | AURKBFLT1METAXLKDR | |
| SCHEMBL29693534 | 0.89 | AXL (0.88) | AURKBFLT1METAXLKDR |
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-2014145693-A1 | METABOLITES OF N-[3-FLUORO-4-({ 6-(METHYLOXY)-7-[(3-MORPHOLIN-4-YLPROPYL)OXY]QUINOLIN-4-YL}OXY)PHENYL]-N'-(4-FLUOROPHENYL)CYCLOPROPANE-1,1-DICARBOXAMIDE | EXELIXIS, INC. (US) | 2014-09-18 | — | — | WO | disclosed |