Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3A | P49840 | 8/20 | 0.42 |
| ▸ | GSK3B | P49841 | 8/20 | 0.42 |
| ▸ | CDK1 | P06493 | 7/20 | 0.42 |
| ▸ | CCNB2 | O95067 | 6/20 | 0.42 |
| ▸ | CCNB1 | P14635 | 6/20 | 0.42 |
| ▸ | CCNB3 | Q8WWL7 | 6/20 | 0.42 |
| ▸ | CDK5 | Q00535 | 5/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 4/20 | 0.42 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.41 |
| ▸ | CDK2 | P24941 | 3/20 | 0.38 |
| ▸ | MAPK8 | P45983 | 3/20 | 0.38 |
| ▸ | CCNE1 | P24864 | 2/20 | 0.38 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.38 |
| ▸ | INSR | P06213 | 1/20 | 0.38 |
| ▸ | CFTR | P13569 | 1/20 | 0.38 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.38 |
| ▸ | MAPK3 | P27361 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.38 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL1056828 | 0.88 | ADORA3 (0.41) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL4370037 | 0.85 | NOS2 (0.41) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL8972110 | 0.83 | KDM4C (0.39) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL16544507 | 0.81 | KDM4C (0.38) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1080357 | 0.77 | CCNB2 (0.40) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL3964555 | 0.77 | ADORA1 (0.43) | KDM4CPDE3BPDE3AADORA3ADORA2A | |
| SCHEMBL8875881 | 0.76 | GSK3B (0.44) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL6641610 | 0.74 | CCNB2 (0.36) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL4295424 | 0.74 | NOS2 (0.58) | GSK3AGSK3BCDK1CCNB2CCNB1 | |
| SCHEMBL1058944 | 0.74 | CCNB2 (0.38) | GSK3AGSK3BCDK1CCNB2CCNB1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3038622-B1 | HETEROCYCLIC COMPOUNDS AND METHODS OF USE | MEDIVATION TECH LLC (US) | 2018-05-30 | — | — | EP | disclosed |