Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 6/20 | 0.55 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.55 |
| ▸ | CIT | O14578 | 1/20 | 0.48 |
| ▸ | BACE1 | P56817 | 2/20 | 0.48 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.48 |
| ▸ | AKT1 | P31749 | 1/20 | 0.46 |
| ▸ | GPR142 | Q7Z601 | 2/20 | 0.45 |
| ▸ | PGR | P06401 | 1/20 | 0.45 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.44 |
| ▸ | SLC1A2 | P43004 | 2/20 | 0.44 |
| ▸ | SLC1A1 | P43005 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 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 | |
|---|---|---|---|---|
| SCHEMBL23486353 | 1.00 | ROCK2 (0.55) | ROCK2ROCK1CITBACE1AAK1 | |
| SCHEMBL2994686 | 0.91 | ROCK2 (0.52) | ROCK2ROCK1CITBACE1AAK1 | |
| SCHEMBL2994692 | 0.91 | ROCK2 (0.52) | ROCK2ROCK1CITBACE1AAK1 | |
| SCHEMBL3008897 | 0.82 | ROCK2 (0.51) | ROCK2ROCK1CITBACE1AAK1 | |
| SCHEMBL3008902 | 0.82 | ROCK2 (0.51) | ROCK2ROCK1CITBACE1AAK1 | |
| SCHEMBL12545542 | 0.76 | KMT2A (0.64) | ROCK1AAK1 | |
| SCHEMBL3010986 | 0.76 | THRB (0.58) | ROCK2ROCK1LMNA | |
| SCHEMBL3010990 | 0.76 | THRB (0.58) | ROCK2ROCK1LMNA | |
| SCHEMBL23486610 | 0.76 | PSMB8 (0.49) | LMNA | |
| SCHEMBL28974351 | 0.76 | ROCK2 (0.54) | ROCK2ROCK1CITBACE1AAK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021110076-A1 | OXAMIDE DERIVATIVES, PREPARATION METHOD THEREFOR AND USE THEREOF IN MEDICINE | 深圳信立泰药业股份有限公司 | 2021-06-10 | — | — | WO | disclosed |