Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 10/20 | 0.34 |
| ▸ | EGFR | P00533 | 9/20 | 0.34 |
| ▸ | BTK | Q06187 | 3/20 | 0.32 |
| ▸ | ACACB | O00763 | 1/20 | 0.31 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.30 |
| ▸ | MTNR1B | P49286 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL16798100 | 0.80 | HTR7 (0.35) | KDREGFRBTK | |
| SCHEMBL16798099 | 0.76 | TGM2 (0.33) | KDR | |
| SCHEMBL16798101 | 0.74 | BTK (0.34) | KDREGFRBTK | |
| SCHEMBL16798041 | 0.73 | BTK (0.34) | KDRBTK | |
| SCHEMBL16765884 | 0.68 | BTK (0.53) | KDREGFRBTK | |
| SCHEMBL16765885 | 0.68 | BTK (0.53) | KDREGFRBTK | |
| SCHEMBL18287076 | 0.61 | MTNR1A (0.51) | ACACBMTNR1AMTNR1B | |
| SCHEMBL20798499 | 0.57 | TSHR (0.56) | ACACBMTNR1AMTNR1B | |
| SCHEMBL2778184 | 0.56 | TSHR (0.60) | ACACBMTNR1AMTNR1B | |
| SCHEMBL24492172 | 0.56 | TSHR (0.54) | ACACB |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3077384-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS WITH ELECTROPHILIC FUNCTIONALITY | F. Hoffmann-La Roche AG (CH) | 2016-10-12 | — | — | EP | disclosed |
| WO-2015082583-A1 | HETEROARYL PYRIDONE AND AZA-PYRIDONE COMPOUNDS WITH ELECTROPHILIC FUNCTIONALITY | F. HOFFMANN-LA ROCHE AG (CH) | 2015-06-11 | — | — | WO | disclosed |