Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 9/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | USP2 | O75604 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | TGM2 | P21980 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.36 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29675364 | 0.87 | HTR3E (0.46) | ACACBCHRNA7NPC1MAPK1 | |
| SCHEMBL18765485 | 0.87 | HTR3E (0.46) | ACACBCHRNA7NPC1MAPK1 | |
| SCHEMBL29675744 | 0.86 | AOC3 (0.45) | ACACBCHRNA7KMT2AMEN1KDM4E | |
| SCHEMBL29675453 | 0.86 | SHMT2 (0.47) | ACACBCHRNA7KMT2AMEN1KDM4E | |
| SCHEMBL29675797 | 0.84 | ACACB (0.49) | ACACBMAPK1 | |
| SCHEMBL29675686 | 0.83 | PIM2 (0.45) | ACACBCHRNA7NPC1MAPK1 | |
| SCHEMBL29675519 | 0.83 | MAPK1 (0.43) | ACACBCHRNA7KDM4EALDH1A1MAPK1 | |
| SCHEMBL29675721 | 0.83 | PIM2 (0.45) | ACACBCHRNA7NPC1MAPK1 | |
| SCHEMBL29675879 | 0.81 | ACACB (0.46) | ACACBMAPK1 | |
| SCHEMBL29675900 | 0.81 | ACACB (0.43) | ACACBCHRNA7MAPK1 |
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 |