Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 4/20 | 0.51 |
| ▸ | CCNK | O75909 | 3/20 | 0.51 |
| ▸ | CDK12 | Q9NYV4 | 3/20 | 0.51 |
| ▸ | NR3C2 | P08235 | 2/20 | 0.36 |
| ▸ | JAK2 | O60674 | 2/20 | 0.36 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | GSK3A | P49840 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | CCNC | P24863 | 2/20 | 0.35 |
| ▸ | CDK8 | P49336 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | CIT | O14578 | 1/20 | 0.34 |
| ▸ | CD38 | P28907 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23147937 | 0.87 | DAO (0.41) | NUDT1CCNKCDK12MAPTGSK3A | |
| SCHEMBL29721863 | 0.87 | DAO (0.41) | NUDT1CCNKCDK12MAPTGSK3A | |
| SCHEMBL29721660 | 0.80 | NUDT1 (0.54) | NUDT1CCNKCDK12CCNCCDK8 | |
| SCHEMBL30731013 | 0.77 | NUDT1 (0.61) | NUDT1CCNKCDK12GSK3AGSK3B | |
| SCHEMBL20839895 | 0.77 | NUDT1 (0.61) | NUDT1CCNKCDK12GSK3AGSK3B | |
| SCHEMBL23147945 | 0.76 | NUDT1 (0.51) | NUDT1 | |
| SCHEMBL23147771 | 0.72 | NUDT1 (0.48) | NUDT1MAPTGSK3AGSK3BCCNC | |
| SCHEMBL23147609 | 0.72 | NUDT1 (0.48) | NUDT1CCNKCDK12MAPTGSK3A | |
| SCHEMBL6637429 | 0.70 | ADORA2A (0.54) | NUDT1CCNKCDK12 | |
| SCHEMBL30061372 | 0.69 | ICAM1 (0.52) | GSK3AGSK3BCCNCCDK8 |
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-114746090-A | Azaindole carboxamide compounds for the treatment of mycobacterial infections | 结核病药物开发全球联盟公司 | 2022-07-12 | — | — | CN | disclosed |