Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.66 |
| ▸ | RET | P07949 | 1/20 | 0.66 |
| ▸ | HRH1 | P35367 | 3/20 | 0.51 |
| ▸ | HTR2C | P28335 | 2/20 | 0.51 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.41 |
| ▸ | CXCR4 | P61073 | 4/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.38 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL7001697 | 0.88 | HTR2A (0.50) | HTR2ARETHRH1HTR2CCXCR4 | |
| SCHEMBL6997509 | 0.87 | HTR2A (0.66) | HTR2ARETHRH1HTR2CSLC6A2 | |
| SCHEMBL2244831 | 0.80 | HTR2A (1.00) | HTR2ARETHRH1HTR2CSLC6A2 | |
| SCHEMBL24631673 | 0.79 | HTR2A (0.46) | HTR2ARETHRH1HTR2CCXCR4 | |
| Hydrochloric Acid SCHEMBL9084155 | 0.79 | HTR2A (0.96) | HTR2ARETHRH1HTR2CSLC6A2 | |
| SCHEMBL4969358 | 0.76 | FNTA (0.41) | HTR2ARETCXCR4CYP3A4 | |
| SCHEMBL12050760 | 0.75 | FNTA (0.45) | HTR2ARETHTR2CCXCR4 | |
| SCHEMBL7995773 | 0.75 | HTR2A (0.62) | HTR2ARETHRH1HTR2C | |
| SCHEMBL22193900 | 0.75 | HTR2A (0.39) | HTR2ARETHTR2CCYP2D6 | |
| SCHEMBL22193783 | 0.75 | RET (0.39) | HTR2ARETCXCR4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1069132-B1 | Bicyclic derivatives of amino-pyrazinones, process of preparation and pharmaceutical compositions comprising them | SERVIER LAB (FR) | 2003-10-01 | — | — | EP | disclosed |
| US-6277851-B1 | ORALLY ADMINISTERED TRYPSIN-RELATED SERINE PROTEASE INHIBITORS; ANTICOAGULANTS | ADIR ET COMPAGNIE (FR) | 2001-08-21 | — | — | US | disclosed |
| EP-1069132-A1 | Bicyclic derivatives of amino-pyrazinones, process of preparation and pharmaceutical compositions comprising them | ADIR ET COMPAGNIE (FR) | 2001-01-17 | — | — | EP | disclosed |