Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 10/20 | 0.82 |
| ▸ | HTR1A | P08908 | 5/20 | 0.70 |
| ▸ | HTR2C | P28335 | 3/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL466829 | 0.90 | SIGMAR1 (1.00) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL8948007 | 0.84 | HTR1A (0.66) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL8110473 | 0.83 | SIGMAR1 (1.00) | SIGMAR1HTR1AHTR2C | |
| Hydrochloric Acid SCHEMBL9449919 | 0.82 | HTR1A (0.98) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL8114274 | 0.80 | GRIN2B (0.60) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL8958513 | 0.79 | SIGMAR1 (0.53) | SIGMAR1HTR1A | |
| SCHEMBL8100660 | 0.78 | SIGMAR1 (1.00) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL8948030 | 0.77 | SIGMAR1 (0.62) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL9449853 | 0.76 | HTR1A (0.86) | SIGMAR1HTR1AHTR2C | |
| SCHEMBL9449586 | 0.75 | SIGMAR1 (0.69) | SIGMAR1HTR1AHTR2C |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5688811-A | PSYCHOLOGICAL DISORDERS; NERVOUS SYSTEM DISORDERS | ADIR ET COMPAGNIE (FR) | 1997-11-18 | — | — | US | disclosed |
| US-5534511-A | AFFINITY FOR SIGMA RECEPTORS, ANTIINFLAMMATORY, TREATMENT OF ARTHRITIS | ADIR ET COMPAGNIE (FR) | 1996-07-09 | — | — | US | disclosed |