Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PYGL | P06737 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.35 |
| ▸ | SLC9A3 | P48764 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL19953528 | 1.00 | PYGL (0.37) | PYGLATMHDAC4HDAC7HDAC5 | |
| SCHEMBL19960839 | 0.82 | HDAC4 (0.39) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| Hydrochloric Acid SCHEMBL19953504 | 0.81 | HDAC4 (0.38) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19960663 | 0.78 | PSEN1 (0.37) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19953533 | 0.78 | FABP5 (0.43) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19953584 | 0.78 | FABP5 (0.43) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19953489 | 0.78 | FABP5 (0.43) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19960578 | 0.77 | HDAC4 (0.33) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19960574 | 0.77 | HDAC4 (0.33) | HDAC4HDAC7HDAC5KCNH2ADRA2A | |
| SCHEMBL19953761 | 0.76 | ACHE (0.43) | ATMHDAC4HDAC7HDAC5KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018047983-A1 | INDANE DERIVATIVES USEFUL AS MODULATORS OF MGLUR7 | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2018-03-15 | — | — | WO | disclosed |