Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 13/20 | 0.85 |
| ▸ | CCR3 | P51677 | 2/20 | 0.82 |
| ▸ | MEN1 | O00255 | 1/20 | 0.67 |
| ▸ | TP53 | P04637 | 1/20 | 0.67 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.67 |
| ▸ | TSHR | P16473 | 1/20 | 0.67 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.67 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL30671729 | 0.93 | SIGMAR1 (0.96) | SIGMAR1CCR3 | |
| SCHEMBL8091647 | 0.93 | CCR3 (0.96) | SIGMAR1CCR3KMT2A | |
| SCHEMBL7366514 | 0.92 | SIGMAR1 (1.00) | SIGMAR1CCR3 | |
| SCHEMBL28881215 | 0.92 | SIGMAR1 (0.93) | SIGMAR1CCR3 | |
| SCHEMBL6550825 | 0.91 | SIGMAR1 (1.00) | SIGMAR1CCR3 | |
| SCHEMBL2962629 | 0.91 | SIGMAR1 (1.00) | SIGMAR1CCR3 | |
| SCHEMBL12040674 | 0.91 | SIGMAR1 (0.75) | SIGMAR1CCR3MEN1TP53CYP1A2 | |
| SCHEMBL492561 | 0.90 | SIGMAR1 (1.00) | SIGMAR1CCR3 | |
| SCHEMBL8091557 | 0.90 | SIGMAR1 (1.00) | SIGMAR1CCR3 | |
| SCHEMBL2056151 | 0.90 | SIGMAR1 (1.00) | SIGMAR1CCR3MEN1TP53CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| US-6057371-A | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, GASTROINTESTINAL DISORDERS, DRUG ABUSE, ANGINA, MIGRAINE, HYPERTENSION AND DEPRESSION | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 2000-05-02 | — | — | US | disclosed |
| EP-0591426-A1 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1994-04-13 | — | — | EP | disclosed |
| WO-1993000313-A2 | SIGMA RECEPTOR LIGANDS AND THE USE THEREOF | VIRGINIA COMMONWEALTH UNIVERSITY (US) | 1993-01-07 | — | — | WO | disclosed |