Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 7/20 | 0.40 |
| ▸ | HTR1A | P08908 | 3/20 | 0.39 |
| ▸ | HTR2A | P28223 | 3/20 | 0.39 |
| ▸ | HTR7 | P34969 | 3/20 | 0.39 |
| ▸ | HTR2B | P41595 | 3/20 | 0.39 |
| ▸ | HTR6 | P50406 | 3/20 | 0.39 |
| ▸ | HTR3A | P46098 | 2/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR5A | P47898 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.38 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.38 |
| ▸ | HTR1D | P28221 | 2/20 | 0.37 |
| ▸ | HTR1B | P28222 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | MAPK10 | P53779 | 3/20 | 0.34 |
| ▸ | LCK | P06239 | 1/20 | 0.34 |
| ▸ | SRC | P12931 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL5227625 | 0.84 | HTR7 (0.37) | HTR1AHTR7HTR2BHTR6OPRK1 | |
| SCHEMBL5230180 | 0.83 | HTR1A (0.42) | MAPK1HTR1AHTR2AHTR7HTR2B | |
| SCHEMBL5226913 | 0.83 | HRH3 (0.45) | HTR1AHTR2AHTR7HTR2BHTR6 | |
| SCHEMBL5227450 | 0.81 | HRH3 (0.42) | MAPK1HTR1AHTR2AHTR7HTR2B | |
| SCHEMBL5230614 | 0.81 | ACHE (0.51) | MAPK1HTR1AHTR2AHTR7HTR2B | |
| SCHEMBL5227779 | 0.80 | ACHE (0.52) | MAPK1HTR1AHTR2AHTR7HTR2B | |
| SCHEMBL2001557 | 0.80 | KCNH2 (0.37) | KCNH2PTGS1PTGS2PSEN1PSEN2 | |
| SCHEMBL5907357 | 0.79 | HTR1A (0.39) | HTR1AHTR7HTR2BHTR6HTR3A | |
| SCHEMBL5225734 | 0.78 | GPR55 (0.39) | — | |
| SCHEMBL5229632 | 0.77 | HTR2A (0.40) | MAPK1HTR1AHTR2AHTR7HTR2B |
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-1611122-B1 | SUBSTITUTED PYRAZOLE COMPOUNDS | MERCK PATENT GMBH (DE) | 2007-06-13 | — | — | EP | disclosed |