Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 4/20 | 0.43 |
| ▸ | HTR2C | P28335 | 2/20 | 0.43 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.42 |
| ▸ | PDE4A | P27815 | 2/20 | 0.42 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.42 |
| ▸ | HTR2B | P41595 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | HTR1D | P28221 | 1/20 | 0.41 |
| ▸ | HTR1B | P28222 | 1/20 | 0.41 |
| ▸ | HTR1E | P28566 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | HTR3A | P46098 | 1/20 | 0.41 |
| ▸ | HTR5A | P47898 | 1/20 | 0.41 |
| ▸ | HTR6 | P50406 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL17185831 | 0.81 | MAPK1 (0.45) | HTR2AHTR2CPDE4BPDE4APDE4C | |
| SCHEMBL13664739 | 0.80 | ALDH1A1 (0.39) | HTR2AHTR2CPDE4BPDE4APDE4C | |
| SCHEMBL13664709 | 0.76 | HTR3A (0.46) | HTR3ASLC6A2SLC6A4SLC6A3 | |
| SCHEMBL13664708 | 0.74 | LMNA (0.42) | ALDH1A1TP53SLC6A2SLC6A3TSHR | |
| SCHEMBL18418699 | 0.74 | MAPK1 (0.40) | HTR2AHTR2CPDE4BPDE4APDE4C | |
| SCHEMBL17197179 | 0.74 | MAPK1 (0.40) | HTR2AHTR2CPDE4BPDE4APDE4C | |
| Hydrochloric Acid SCHEMBL17185828 | 0.73 | MAPK1 (0.40) | HTR2AHTR2CPDE4BPDE4APDE4C | |
| SCHEMBL5584961 | 0.72 | HTR2A (0.58) | HTR2AHTR2CPDE4BHTR2BHTR1A | |
| SCHEMBL17197216 | 0.71 | ALDH1A1 (0.40) | HTR2AHTR2CPDE4BPDE4APDE4C | |
| SCHEMBL18418762 | 0.70 | ALDH1A1 (0.52) | HTR2AHTR2CPDE4BPDE4APDE4C |
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-2009119528-A1 | HETEROCYCLIC COMPOUND | 武田薬品工業株式会社 (JP) | 2009-10-01 | — | — | WO | disclosed |