Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.32 |
| ▸ | FBP1 | P09467 | 2/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21138201 | 0.77 | ABCB1 (0.31) | ABCB1HSP90AB1FBP1 | |
| SCHEMBL21159333 | 0.77 | PDE8B (0.43) | — | |
| SCHEMBL21057455 | 0.71 | KDM1A (0.40) | — | |
| SCHEMBL21159424 | 0.70 | — | — | |
| SCHEMBL21159259 | 0.70 | TLR7 (0.36) | FBP1 | |
| SCHEMBL29386483 | 0.66 | CDK1 (0.60) | — | |
| SCHEMBL14619182 | 0.66 | CDK1 (0.60) | — | |
| SCHEMBL26348959 | 0.63 | AHCY (0.44) | — | |
| SCHEMBL4956793 | 0.63 | HSP90AB1 (0.48) | ABCB1HSP90AB1 | |
| SCHEMBL29388366 | 0.62 | CDK1 (0.67) | — |
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-3505171-A1 | BICYCLIC NITROGENATED HETEROCYCLIC COMPOUND | Mitsubishi Tanabe Pharma Corporation (JP) | 2019-07-03 | — | — | EP | disclosed |