Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 10/20 | 0.77 |
| ▸ | HTR1D | P28221 | 10/20 | 0.77 |
| ▸ | HTR1B | P28222 | 7/20 | 0.77 |
| ▸ | HTR2A | P28223 | 7/20 | 0.58 |
| ▸ | TRPM8 | Q7Z2W7 | 4/20 | 0.54 |
| ▸ | HTR2C | P28335 | 3/20 | 0.54 |
| ▸ | HTR7 | P34969 | 3/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | TSHR | P16473 | 2/20 | 0.54 |
| ▸ | HTR6 | P50406 | 2/20 | 0.54 |
| ▸ | HTR4 | Q13639 | 2/20 | 0.54 |
| ▸ | HTR2B | P41595 | 2/20 | 0.54 |
| ▸ | MPO | P05164 | 1/20 | 0.54 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.54 |
| ▸ | HTR3B | O95264 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | DRD1 | P21728 | 1/20 | 0.54 |
| ▸ | HTR1E | P28566 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4512060 | 0.87 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2ATRPM8 | |
| SCHEMBL8297234 | 0.87 | HTR1D (0.67) | HTR1AHTR1DHTR1BHTR2ATRPM8 | |
| Hydrochloric Acid SCHEMBL7809324 | 0.86 | HTR1A (0.97) | HTR1AHTR1DHTR1BHTR2ATRPM8 | |
| SCHEMBL1913860 | 0.86 | HTR1A (0.81) | HTR1AHTR1DHTR1BHTR2ATRPM8 | |
| SCHEMBL12013054 | 0.84 | HTR1D (0.73) | HTR1AHTR1DHTR1B | |
| SCHEMBL10778563 | 0.84 | HTR1A (0.74) | HTR1AHTR1DHTR1BMPO | |
| SCHEMBL8920992 | 0.82 | HTR1A (0.97) | HTR1AHTR1DHTR1BHTR2ATRPM8 | |
| SCHEMBL27389088 | 0.81 | HTR1D (0.59) | HTR1AHTR1DHTR1BHTR2AHTR2C | |
| SCHEMBL23771174 | 0.81 | HTR1A (0.56) | HTR1AHTR1DHTR1BHTR2AHTR2C | |
| SCHEMBL14975308 | 0.81 | HTR1A (1.00) | HTR1AHTR1DHTR1BHTR2ATRPM8 |
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-2005002500-A2 | INHIBITORS OF CORONAVIRUS | MERCK & CO., INC. (US) | 2005-01-13 | — | — | WO | disclosed |