Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.37 |
| ▸ | HTR3B | O95264 | 1/20 | 0.37 |
| ▸ | HTR3A | P46098 | 1/20 | 0.37 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.37 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.37 |
| ▸ | HTR2A | P28223 | 3/20 | 0.36 |
| ▸ | HTR2C | P28335 | 3/20 | 0.36 |
| ▸ | HTR2B | P41595 | 3/20 | 0.36 |
| ▸ | TACR1 | P25103 | 3/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.34 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.33 |
| ▸ | HTR1D | P28221 | 1/20 | 0.33 |
| ▸ | HTR1B | P28222 | 1/20 | 0.33 |
| ▸ | MTNR1B | P49286 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL4132230 | 1.00 | SIGMAR1 (0.39) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL5200282 | 1.00 | SIGMAR1 (0.39) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| Hydrochloric Acid SCHEMBL4132226 | 1.00 | SIGMAR1 (0.39) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL4121207 | 0.93 | SIGMAR1 (0.36) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL4121203 | 0.93 | SIGMAR1 (0.36) | SIGMAR1HTR3EHTR3BHTR3AHTR3D | |
| SCHEMBL5198931 | 0.90 | SIGMAR1 (0.44) | SIGMAR1HTR2AHTR2CHTR2BMTNR1B | |
| SCHEMBL5198934 | 0.90 | SIGMAR1 (0.44) | SIGMAR1HTR2AHTR2CHTR2BMTNR1B | |
| Hydrochloric Acid SCHEMBL4121450 | 0.90 | SIGMAR1 (0.44) | SIGMAR1HTR2AHTR2CHTR2BMTNR1B | |
| Hydrochloric Acid SCHEMBL4121446 | 0.90 | SIGMAR1 (0.44) | SIGMAR1HTR2AHTR2CHTR2BMTNR1B | |
| Hydrochloric Acid SCHEMBL4124549 | 0.90 | SIGMAR1 (0.39) | SIGMAR1HTR3EHTR3BHTR3AHTR3D |
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-1710240-A1 | Piperazine derivatives and their use as serotonin reuptake inhibitors or as neurokinin antagonists | Les Laboratoires Servier (FR) | 2006-10-11 | — | — | EP | disclosed |