Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.49 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.44 |
| ▸ | ACACB | O00763 | 5/20 | 0.42 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.37 |
| ▸ | IDH1 | O75874 | 3/20 | 0.37 |
| ▸ | IDH2 | P48735 | 2/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.37 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.37 |
| ▸ | RORC | P51449 | 1/20 | 0.36 |
| ▸ | SYK | P43405 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675858 | 0.81 | NPSR1 (0.39) | ACACBMAPK1TGFBR1ALDH1A1 | |
| SCHEMBL29676316 | 0.81 | ACACB (0.53) | ADRB1P2RX7ACACBTAS2R14IDH1 | |
| SCHEMBL29675377 | 0.76 | ACACB (0.46) | ACACBMAPK1ALDH1A1 | |
| SCHEMBL18765710 | 0.76 | KCNA5 (0.42) | ACACBMAPK1KCNK3 | |
| SCHEMBL1111155 | 0.75 | ADRB1 (0.52) | ADRB1P2RX7ACACBTAS2R14IDH1 | |
| SCHEMBL23343865 | 0.74 | ADRB1 (0.54) | ADRB1P2RX7IDH1IDH2 | |
| SCHEMBL1111154 | 0.72 | ACACB (0.49) | ADRB1P2RX7ACACB | |
| SCHEMBL29676282 | 0.72 | TRPV3 (0.47) | ACACB | |
| SCHEMBL24015882 | 0.72 | ALDH1A1 (0.44) | MAPK1ALDH1A1 | |
| SCHEMBL24015880 | 0.72 | ALDH1A1 (0.44) | MAPK1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | claimed |