Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 7/20 | 0.62 |
| ▸ | NOTUM | Q6P988 | 8/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4722109 | 1.00 | AR (0.62) | ARNOTUMHSD11B1CDK1CDK2 | |
| SCHEMBL15564231 | 0.81 | AR (0.64) | AR | |
| SCHEMBL2935853 | 0.81 | NOTUM (0.49) | ARNOTUMHSD11B1CDK1CDK2 | |
| SCHEMBL15938046 | 0.80 | AR (0.67) | ARNOTUMCDK1CDK2 | |
| SCHEMBL16071294 | 0.80 | AR (0.67) | ARNOTUMCDK1CDK2 | |
| SCHEMBL15938045 | 0.80 | AR (0.67) | ARNOTUMCDK1CDK2 | |
| SCHEMBL4723399 | 0.80 | NOTUM (0.48) | ARNOTUMHSD11B1CDK1CDK2 | |
| SCHEMBL4723392 | 0.80 | NOTUM (0.48) | ARNOTUMHSD11B1CDK1CDK2 | |
| SCHEMBL1409422 | 0.78 | NOTUM (0.67) | ARNOTUMHSD11B1 | |
| SCHEMBL13651213 | 0.77 | AR (1.00) | ARNOTUM |
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-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |