Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IP6K1 | Q92551 | 8/20 | 0.44 |
| ▸ | IP6K3 | Q96PC2 | 1/20 | 0.44 |
| ▸ | IP6K2 | Q9UHH9 | 1/20 | 0.44 |
| ▸ | GPR183 | P32249 | 3/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 8/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3256194 | 1.00 | IP6K1 (0.44) | IP6K1IP6K3IP6K2GPR183HRH4 | |
| SCHEMBL3255853 | 0.77 | IP6K1 (0.43) | IP6K1IP6K3IP6K2GPR183HRH4 | |
| SCHEMBL3255524 | 0.77 | HRH4 (0.58) | IP6K1IP6K3IP6K2GPR183HRH4 | |
| SCHEMBL3252765 | 0.77 | HRH4 (0.58) | IP6K1IP6K3IP6K2GPR183HRH4 | |
| SCHEMBL3247437 | 0.76 | IP6K1 (0.47) | IP6K1IP6K3IP6K2HTR1AHTR2A | |
| SCHEMBL3247439 | 0.76 | IP6K1 (0.47) | IP6K1IP6K3IP6K2HTR1AHTR2A | |
| SCHEMBL3251888 | 0.76 | AVPR1A (0.49) | HRH4 | |
| SCHEMBL3251885 | 0.76 | AVPR1A (0.49) | HRH4 | |
| SCHEMBL3252852 | 0.76 | HRH4 (0.55) | IP6K1IP6K3IP6K2HRH4 | |
| SCHEMBL3255772 | 0.73 | AVPR1A (0.49) | HRH4 |
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-2102207-B1 | SPIRO-PIPERIDINE DERIVATIVES AS VIA RECEPTOR ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-06-02 | — | — | EP | claimed |