Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 7/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | RBP4 | P02753 | 2/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | GALR2 | O43603 | 1/20 | 0.39 |
| ▸ | GALR1 | P47211 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3878661 | 1.00 | HSD11B1 (0.42) | HSD11B1GAARBP4TRPA1TRPV1 | |
| SCHEMBL3880146 | 0.92 | HSD11B1 (0.43) | HSD11B1GAARBP4TRPA1TRPV1 | |
| SCHEMBL3880138 | 0.92 | HSD11B1 (0.43) | HSD11B1GAARBP4TRPA1TRPV1 | |
| SCHEMBL3884755 | 0.89 | HSD11B1 (0.45) | HSD11B1TRPV1GALR2GALR1 | |
| SCHEMBL3882178 | 0.89 | GAA (0.43) | HSD11B1GAARBP4TRPA1TRPV1 | |
| SCHEMBL3877637 | 0.85 | HSD11B1 (0.46) | HSD11B1GAARBP4GALR2GALR1 | |
| SCHEMBL3946732 | 0.82 | TRPV1 (0.42) | HSD11B1TRPV1 | |
| SCHEMBL3880682 | 0.81 | HSD11B1 (0.46) | HSD11B1GAARBP4TRPA1TRPV1 | |
| SCHEMBL3876842 | 0.81 | HSD11B1 (0.49) | HSD11B1TRPV1 | |
| SCHEMBL3877152 | 0.80 | HSD11B1 (0.47) | HSD11B1GALR2GALR1 |
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 3 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 | 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 |