Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 6/20 | 0.49 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.47 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.42 |
| ▸ | CDK4 | P11802 | 1/20 | 0.41 |
| ▸ | CCND3 | P30281 | 1/20 | 0.41 |
| ▸ | GSK3B | P49841 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL3877200 | 0.93 | HSD11B1 (0.51) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL3880078 | 0.89 | HSD11B1 (0.51) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL14613836 | 0.89 | HSD11B1 (0.51) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL3878973 | 0.87 | HSD11B1 (0.47) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL3879636 | 0.86 | TRPV1 (0.49) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL13766131 | 0.85 | HSD11B1 (0.47) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL3878966 | 0.84 | HSD11B1 (0.48) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL3880711 | 0.84 | HSD11B1 (0.45) | HSD11B1TRPA1TRPV1CDK4CCND3 | |
| SCHEMBL3879429 | 0.84 | HSD11B1 (0.53) | HSD11B1TRPA1TRPV1EPHX2 | |
| SCHEMBL3879528 | 0.83 | TRPA1 (0.51) | HSD11B1TRPA1TRPV1 |
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-1823057-A | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORP (US) | 2006-08-23 | — | — | CN | disclosed |