Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNA7 | P36544 | 1/20 | 0.44 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.33 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.33 |
| ▸ | MAP3K12 | Q12852 | 1/20 | 0.32 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.31 |
| ▸ | CDK9 | P50750 | 1/20 | 0.31 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.30 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.30 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.30 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
| ▸ | RAF1 | P04049 | 1/20 | 0.30 |
| ▸ | BRAF | P15056 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25147093 | 0.87 | CHRNA7 (0.40) | CHRNA7TLR9TLR8TLR7MAP3K12 | |
| SCHEMBL4569947 | 0.84 | CHRNA7 (0.47) | CHRNA7TLR9TLR8TLR7MAP3K12 | |
| SCHEMBL15999346 | 0.83 | CHRNA7 (0.42) | CHRNA7TLR9TLR8TLR7MAP3K12 | |
| SCHEMBL15999369 | 0.79 | CHRNA7 (0.44) | CHRNA7TLR9TLR8TLR7MAP3K12 | |
| SCHEMBL24823782 | 0.78 | CHRNA7 (0.43) | CHRNA7TLR9TLR8TLR7MAP3K12 | |
| SCHEMBL22545239 | 0.73 | ASIC3 (0.40) | CHRNA7 | |
| SCHEMBL30856759 | 0.73 | ASIC3 (0.40) | CHRNA7 | |
| SCHEMBL20899259 | 0.73 | KMO (0.34) | MAP3K12 | |
| SCHEMBL29850110 | 0.73 | KDM4E (0.36) | — | |
| SCHEMBL24620393 | 0.72 | MGLL (0.39) | MAP3K12RAF1BRAF |
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-2020210380-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | NUVATION BIO INC. (US) | 2020-10-15 | — | — | WO | disclosed |