Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 2/20 | 0.54 |
| ▸ | BRD4 | O60885 | 3/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.47 |
| ▸ | JAK1 | P23458 | 1/20 | 0.47 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.46 |
| ▸ | GLS | O94925 | 3/20 | 0.44 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 2/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | USP30 | Q70CQ3 | 1/20 | 0.43 |
| ▸ | CCKBR | P32239 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL24732888 | 1.00 | ROCK2 (0.54) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL15348038 | 0.85 | ALDH1A1 (0.46) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL15348037 | 0.85 | ALDH1A1 (0.46) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL13334315 | 0.82 | BCHE (0.45) | ROCK2BRD4 | |
| SCHEMBL31709823 | 0.81 | BRD4 (0.54) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL731764 | 0.81 | BRD4 (0.54) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL25048390 | 0.81 | BRD4 (0.47) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL7238726 | 0.80 | BRD4 (0.48) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL14894253 | 0.79 | JAK2 (0.45) | ROCK2BRD4JAK2JAK1CREBBP | |
| SCHEMBL20246342 | 0.79 | JAK2 (0.49) | ROCK2BRD4JAK2JAK1CREBBP |
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-114805341-B | Aromatic heterocyclic compound, and preparation method and application thereof | 上海翊石医药科技有限公司 | 2023-12-08 | — | — | CN | disclosed |