Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 12/20 | 0.39 |
| ▸ | ROCK2 | O75116 | 12/20 | 0.39 |
| ▸ | JAK3 | P52333 | 12/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 11/20 | 0.39 |
| ▸ | JAK2 | O60674 | 11/20 | 0.39 |
| ▸ | JAK1 | P23458 | 10/20 | 0.39 |
| ▸ | TYK2 | P29597 | 10/20 | 0.39 |
| ▸ | STAT5A | P42229 | 1/20 | 0.39 |
| ▸ | PRKCD | Q05655 | 1/20 | 0.37 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.36 |
| ▸ | CDK4 | P11802 | 1/20 | 0.36 |
| ▸ | CCND1 | P24385 | 1/20 | 0.36 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.36 |
| ▸ | CDK2 | P24941 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
| ▸ | CCNC | P24863 | 1/20 | 0.33 |
| ▸ | CDK8 | P49336 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL20331813 | 0.81 | CCNE2 (0.39) | IKBKBROCK2JAK3ROCK1JAK2 | |
| SCHEMBL28233094 | 0.81 | MEN1 (0.41) | CCNE2CDK4CCND1CCNE1CDK2 | |
| SCHEMBL17437183 | 0.75 | MET (0.52) | IKBKBROCK2JAK3ROCK1JAK2 | |
| SCHEMBL17981304 | 0.74 | ADRA2A (0.47) | IKBKBROCK2JAK3ROCK1JAK2 | |
| SCHEMBL18024193 | 0.72 | IKBKB (0.36) | IKBKBROCK2JAK3ROCK1JAK2 | |
| SCHEMBL17437239 | 0.72 | BRPF1 (0.45) | IKBKBROCK2JAK3ROCK1JAK2 | |
| SCHEMBL28245363 | 0.71 | IMPDH2 (0.45) | ROCK2ROCK1MEN1KMT2AALDH1A1 | |
| SCHEMBL6862073 | 0.71 | IMPDH2 (0.53) | ROCK2ROCK1 | |
| SCHEMBL17437173 | 0.71 | LMNA (0.56) | IKBKBROCK2JAK3ROCK1JAK2 | |
| SCHEMBL27689981 | 0.70 | ALDH1A1 (0.50) | CCNE2CDK4CCND1CCNE1CDK2 |
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-106817900-A | Novel naphthyridines and isoquinolin and its purposes as CDK8/19 inhibitor | 默克专利有限公司 | 2017-06-09 | — | — | CN | disclosed |