Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRK1 | P41145 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 2/20 | 0.37 |
| ▸ | CTSD | P07339 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 2/20 | 0.36 |
| ▸ | HTR6 | P50406 | 2/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | CACNA1F | O60840 | 2/20 | 0.36 |
| ▸ | CACNA1D | Q01668 | 2/20 | 0.36 |
| ▸ | CACNA1S | Q13698 | 2/20 | 0.36 |
| ▸ | CACNA1C | Q13936 | 2/20 | 0.36 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL19720790 | 0.89 | ALDH1A1 (0.42) | OPRK1BCHEHTR6KDM4EGAA | |
| SCHEMBL19720631 | 0.86 | PDE4B (0.46) | BACE1CTSDPDE4BUSP30HDAC1 | |
| SCHEMBL16895590 | 0.83 | USP30 (0.39) | BACE1CTSDBCHEHTR6USP30 | |
| SCHEMBL16895591 | 0.83 | USP30 (0.39) | BACE1CTSDBCHEHTR6USP30 | |
| SCHEMBL16895734 | 0.76 | BTK (0.39) | OPRK1BACE1CTSDPDE4BBCHE | |
| SCHEMBL16895737 | 0.76 | BTK (0.39) | OPRK1BACE1CTSDPDE4BBCHE | |
| SCHEMBL19720586 | 0.76 | USP30 (0.43) | BACE1CTSDUSP30HDAC1HDAC2 | |
| SCHEMBL19720629 | 0.75 | PDE4B (0.42) | PDE4BUSP30 | |
| SCHEMBL16895672 | 0.75 | HCAR1 (0.45) | OPRK1PDE4BBCHEHTR6 | |
| SCHEMBL16895670 | 0.75 | HCAR1 (0.45) | OPRK1PDE4BBCHEHTR6 |
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-3257848-A1 | COMPOUNDS AND COMPOSITIONS FOR MODULATING EGFR ACTIVITY | Novartis AG (CH) | 2017-12-20 | — | — | EP | disclosed |