Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | KCNK3 | O14649 | 3/20 | 0.35 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | EP300 | Q09472 | 1/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3894535 | 1.00 | HDAC6 (0.36) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4097112 | 0.83 | MEN1 (0.43) | KCNK3HTR7HTR1AHTR2ATSHR | |
| SCHEMBL4097113 | 0.83 | MEN1 (0.43) | KCNK3HTR7HTR1AHTR2ATSHR | |
| SCHEMBL13866959 | 0.82 | CNR2 (0.41) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL13866943 | 0.82 | CNR2 (0.41) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL4711770 | 0.82 | HTR2C (0.34) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3889267 | 0.80 | HDAC10 (0.35) | HDAC6HDAC10KCNK3HTR7HTR1A | |
| SCHEMBL3889272 | 0.80 | HDAC10 (0.35) | HDAC6HDAC10KCNK3HTR7HTR1A | |
| SCHEMBL13866955 | 0.78 | CNR2 (0.36) | HDAC6HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL13866952 | 0.78 | CNR2 (0.36) | HDAC6HDAC3HDAC4HDAC1HDAC7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1863479-A1 | TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS CROSS REFERENCE TO RELATED APPLICATIONS | JANSSEN PHARMACEUTICA N.V. (BE) | 2007-12-12 | — | — | EP | disclosed |
| WO-2006107561-A1 | TETRAHYDROTHIOPYRANO PYRAZOLE CANNABINOID MODULATORS | JANSSEN PHARMACEUTICA, N.V. (BE) | 2006-10-12 | — | — | WO | disclosed |