Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 5/20 | 0.40 |
| ▸ | CKS1B | P61024 | 1/20 | 0.39 |
| ▸ | SKP1 | P63208 | 1/20 | 0.39 |
| ▸ | SKP2 | Q13309 | 1/20 | 0.39 |
| ▸ | AURKA | O14965 | 3/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 3/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 3/20 | 0.39 |
| ▸ | CNR2 | P34972 | 4/20 | 0.38 |
| ▸ | CNR1 | P21554 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
| ▸ | ALOX5AP | P20292 | 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 | |
|---|---|---|---|---|
| SCHEMBL1721433 | 0.98 | BTK (0.41) | BTKHTR7CKS1BSKP1SKP2 | |
| SCHEMBL653783 | 0.87 | AURKA (0.46) | BTKAURKAPDPK1AURKBPDE10A | |
| SCHEMBL653784 | 0.87 | AURKA (0.46) | BTKAURKAPDPK1AURKBPDE10A | |
| SCHEMBL656583 | 0.86 | CKS1B (0.49) | BTKCKS1BSKP1SKP2AURKA | |
| SCHEMBL656582 | 0.86 | CKS1B (0.49) | BTKCKS1BSKP1SKP2AURKA | |
| SCHEMBL653066 | 0.79 | CNR2 (0.55) | AURKACNR2CNR1CYP2D6KDM4E | |
| SCHEMBL794422 | 0.78 | HRH4 (0.46) | CNR2CNR1KDM4EMEN1KMT2A | |
| SCHEMBL652168 | 0.75 | ATF4 (0.43) | ALDH1A1 | |
| SCHEMBL652167 | 0.75 | ATF4 (0.43) | ALDH1A1 | |
| SCHEMBL1694112 | 0.75 | CNR2 (0.55) | HTR7AURKACNR2CNR1CYP2D6 |
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-2011147753-A1 | ANTIVIRAL ACTIVITY OF NOVEL BICYCLIC HETEROCYCLES | KATHOLIEKE UNIVERSITEIT LEUVEN, K.U.LEUVEN R&D (BE) | 2011-12-01 | — | — | WO | disclosed |