Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | DRD2 | P14416 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 1/20 | 0.31 |
| ▸ | HRH1 | P35367 | 1/20 | 0.31 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14912863 | 0.80 | ADORA2A (0.33) | BTKLMNADRD2HTR2AHRH1 | |
| SCHEMBL14912660 | 0.78 | ALDH1A1 (0.32) | BTKLMNADRD2HTR2AHRH1 | |
| SCHEMBL14934068 | 0.71 | DRD2 (0.36) | LMNADRD2HTR2AHRH1 | |
| SCHEMBL22421143 | 0.71 | ROCK2 (0.32) | — | |
| SCHEMBL14912990 | 0.68 | BTK (0.50) | BTK | |
| SCHEMBL21946763 | 0.60 | GRM5 (0.31) | — | |
| SCHEMBL22330448 | 0.59 | DRD2 (0.33) | DRD2HTR2AHRH1 | |
| SCHEMBL13559798 | 0.58 | HTR2A (0.40) | LMNADRD2HTR2AHRH1 | |
| SCHEMBL22330388 | 0.58 | P2RX7 (0.36) | DRD2HTR2AHRH1 | |
| SCHEMBL20778360 | 0.58 | DRD2 (0.32) | LMNADRD2HTR2AHRH1 |
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-3002284-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS AS INHIBITORS OF BTK ACTIVITY | F. Hoffmann-La Roche AG (CH) | 2016-04-06 | — | — | EP | disclosed |