Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 7/20 | 0.47 |
| ▸ | PGK1 | P00558 | 1/20 | 0.40 |
| ▸ | PGK2 | P07205 | 1/20 | 0.40 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | TGFBR2 | P37173 | 1/20 | 0.37 |
| ▸ | ACACA | Q13085 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CTRB1 | P17538 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL23666724 | 0.81 | RAB9A (0.43) | ACACBIKBKBACACAALDH1A1 | |
| SCHEMBL2784760 | 0.80 | STAT3 (0.40) | ACACBIKBKBACACA | |
| SCHEMBL29676316 | 0.80 | ACACB (0.53) | ACACBNPSR1 | |
| SCHEMBL29675858 | 0.80 | NPSR1 (0.39) | ACACBPGK1PGK2NPSR1TGFBR1 | |
| SCHEMBL12344319 | 0.79 | IKBKB (0.38) | ACACBIKBKBL3MBTL1ACACA | |
| SCHEMBL31592656 | 0.78 | ROCK2 (0.53) | ACACBACACA | |
| SCHEMBL29675892 | 0.78 | NPSR1 (0.44) | ACACBIKBKBNPSR1ACACAALDH1A1 | |
| SCHEMBL29676696 | 0.78 | ROCK2 (0.53) | ACACBACACA | |
| SCHEMBL29676186 | 0.78 | ACACB (0.48) | ACACBIKBKBACACAALDH1A1 | |
| SCHEMBL22242020 | 0.76 | ACACB (0.40) | ACACBIKBKBACACA |
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 |