Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 11/20 | 0.60 |
| ▸ | ACACA | Q13085 | 9/20 | 0.60 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.54 |
| ▸ | ROCK2 | O75116 | 2/20 | 0.54 |
| ▸ | PRKACA | P17612 | 2/20 | 0.54 |
| ▸ | GSK3A | P49840 | 2/20 | 0.54 |
| ▸ | GSK3B | P49841 | 2/20 | 0.54 |
| ▸ | PRKX | P51817 | 2/20 | 0.54 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.54 |
| ▸ | DYRK3 | O43781 | 1/20 | 0.54 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.54 |
| ▸ | CDK2 | P24941 | 1/20 | 0.54 |
| ▸ | AKT2 | P31751 | 1/20 | 0.54 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.54 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.54 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.54 |
| ▸ | PRKG2 | Q13237 | 1/20 | 0.54 |
| ▸ | PRKG1 | Q13976 | 1/20 | 0.54 |
| ▸ | PKN2 | Q16513 | 1/20 | 0.54 |
| ▸ | MINK1 | Q8N4C8 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL13645881 | 0.84 | ACACB (0.61) | ACACBACACAMTNR1AMTNR1B | |
| SCHEMBL24675663 | 0.83 | ROCK1 (0.49) | ACACBACACAROCK1ROCK2PRKACA | |
| SCHEMBL29676445 | 0.83 | MTNR1A (0.55) | ACACBACACAMTNR1AMTNR1B | |
| SCHEMBL13645850 | 0.81 | ACACB (0.71) | ACACBACACAMTNR1AMTNR1B | |
| SCHEMBL13645878 | 0.81 | ACACB (0.58) | ACACBACACAMTNR1AMTNR1B | |
| SCHEMBL6969020 | 0.81 | ACACB (0.67) | ACACBACACAROCK1ROCK2PRKACA | |
| SCHEMBL14380839 | 0.81 | ACACB (0.67) | ACACBACACAROCK1ROCK2PRKACA | |
| SCHEMBL7638337 | 0.79 | KDM4E (0.62) | ROCK1ROCK2PRKACAGSK3AGSK3B | |
| SCHEMBL24675827 | 0.77 | ROCK1 (0.46) | ACACBACACAROCK1ROCK2PRKACA | |
| SCHEMBL24675824 | 0.77 | ROCK1 (0.46) | ACACBACACAROCK1ROCK2PRKACA |
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 3 patents. 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 |
| CN-114948963-A | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-08-30 | — | — | CN | disclosed |
| CN-108617166-B | Protein kinase inhibitor benzolactam compounds | 大冢制药株式会社 | 2022-05-17 | — | — | CN | disclosed |