Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL21295852 | 0.73 | KDM4E (0.32) | CYP2A6 | |
| SCHEMBL21295873 | 0.67 | PDPK1 (0.34) | — | |
| SCHEMBL21295810 | 0.65 | MAPT (0.34) | — | |
| SCHEMBL21295811 | 0.64 | CYP2A6 (0.47) | CYP2A6 | |
| SCHEMBL21300515 | 0.61 | KDM4E (0.41) | — | |
| SCHEMBL23182 | 0.60 | — | — | |
| SCHEMBL452450 | 0.60 | — | — | |
| SCHEMBL9764660 | 0.60 | CYP2A6 (0.32) | CYP2A6 | |
| SCHEMBL70966 | 0.59 | — | — | |
| SCHEMBL29149 | 0.58 | — | — |
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-0662964-B1 | HETEROCYCLIC AMINES HAVING CALMODULIN ANTAGONIST PROPERTIES | BRITISH TECH GROUP (GB) | 1997-06-11 | — | — | EP | disclosed |