Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 8/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 2/20 | 0.46 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.46 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.41 |
| ▸ | RBP4 | P02753 | 1/20 | 0.41 |
| ▸ | CDK4 | P11802 | 1/20 | 0.40 |
| ▸ | CCND3 | P30281 | 1/20 | 0.40 |
| ▸ | GSK3B | P49841 | 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 | |
|---|---|---|---|---|
| SCHEMBL3876553 | 0.93 | HSD11B1 (0.49) | HSD11B1TRPA1HRH4TRPV1RBP4 | |
| SCHEMBL3877757 | 0.90 | HSD11B1 (0.43) | HSD11B1TRPV1 | |
| SCHEMBL3882474 | 0.89 | HSD11B1 (0.48) | HSD11B1TRPA1HRH4TRPV1RBP4 | |
| SCHEMBL3882734 | 0.88 | HSD11B1 (0.44) | HSD11B1TRPA1TRPV1 | |
| SCHEMBL14614254 | 0.88 | HSD11B1 (0.46) | HSD11B1TRPA1 | |
| SCHEMBL3876010 | 0.87 | GALR2 (0.43) | HSD11B1 | |
| SCHEMBL3879462 | 0.87 | HSD11B1 (0.51) | HSD11B1TRPA1HRH4TRPV1 | |
| SCHEMBL3885699 | 0.86 | HSD11B1 (0.49) | HSD11B1TRPA1HRH4TRPV1 | |
| SCHEMBL3887698 | 0.85 | HSD11B1 (0.53) | HSD11B1TRPA1HRH4TRPV1RBP4 | |
| SCHEMBL3877303 | 0.84 | HRH4 (0.59) | HSD11B1TRPA1HRH4TRPV1CDK4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | claimed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| US-7566712-B2 | Biaryl piperazinyl-pyridine analogues | NEUROGEN CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |