Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 1/20 | 0.43 |
| ▸ | TACR1 | P25103 | 18/20 | 0.42 |
| ▸ | ABHD6 | Q9BV23 | 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 | |
|---|---|---|---|---|
| SCHEMBL543190 | 0.87 | KCNH2 (0.42) | ABHD6 | |
| SCHEMBL4679033 | 0.76 | GRIN2B (0.52) | — | |
| SCHEMBL5664876 | 0.74 | TACR1 (0.44) | TACR1 | |
| SCHEMBL5663860 | 0.74 | TACR1 (0.44) | TACR1 | |
| SCHEMBL543034 | 0.73 | TACR1 (0.47) | ADRB1TACR1 | |
| SCHEMBL3158223 | 0.73 | ALDH1A1 (0.39) | TACR1 | |
| SCHEMBL16935385 | 0.72 | ABHD6 (0.42) | ABHD6 | |
| SCHEMBL31024103 | 0.72 | GRIN2B (0.48) | — | |
| SCHEMBL1712728 | 0.69 | CA2 (0.43) | ABHD6 | |
| SCHEMBL22882574 | 0.69 | TACR1 (0.41) | TACR1 |
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-2414330-A2 | PIPERIDINE AND PIPERAZINE DERIVATIVES AS AUTOTAXIN INHIBITORS | Merck Patent GmbH (DE) | 2012-02-08 | — | — | EP | claimed |