Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 5/20 | 0.46 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | HTR2B | P41595 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 2/20 | 0.39 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.38 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | NSD1 | Q96L73 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.38 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.37 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.37 |
| ▸ | CDK1 | P06493 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5313535 | 0.87 | KDM4E (0.42) | CACNA2D1HTR2BGAAHTR1AADRA1D | |
| SCHEMBL5311668 | 0.86 | KDM4E (0.54) | HTR2BGAAHTR1AADRA1DKDM4E | |
| SCHEMBL1695394 | 0.85 | CACNA2D1 (0.52) | CACNA2D1HTR2CHTR2BGAAHTR1A | |
| SCHEMBL4742329 | 0.80 | CDK1 (0.48) | CACNA2D1HTR2CHTR2BGAAHTR1A | |
| SCHEMBL1695371 | 0.72 | CACNA2D1 (0.51) | CACNA2D1HTR2CHTR2BADRA1DKDM4E | |
| SCHEMBL708875 | 0.72 | KDM4E (0.44) | CACNA2D1HTR2BGAAHTR1AADRA1D | |
| SCHEMBL29510791 | 0.72 | KDM4E (0.44) | CACNA2D1HTR2BGAAHTR1AADRA1D | |
| SCHEMBL710488 | 0.71 | KDM4E (0.58) | HTR2BGAAHTR1AADRA1DKDM4E | |
| SCHEMBL4745453 | 0.71 | KDM4E (0.43) | CACNA2D1HTR2BHTR1AADRA1DKDM4E | |
| SCHEMBL29510895 | 0.71 | KDM4E (0.58) | HTR2BGAAHTR1AADRA1DKDM4E |
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-2007040469-A2 | CHLOROQUINE COUPLED COMPOSITIONS AND METHODS FOR THEIR SYNTHESIS | KOSAK KEN M (US) | 2007-04-12 | — | — | WO | disclosed |