Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 15/20 | 0.39 |
| ▸ | TACR2 | P21452 | 2/20 | 0.39 |
| ▸ | TACR3 | P29371 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4630169 | 0.90 | TACR1 (0.43) | TACR1TACR2TACR3 | |
| SCHEMBL5703559 | 0.88 | TACR1 (0.37) | TACR1TACR2TACR3 | |
| SCHEMBL4629935 | 0.85 | TACR1 (0.42) | TACR1TACR2TACR3PGR | |
| SCHEMBL7750052 | 0.83 | TACR1 (0.40) | TACR1TACR2TACR3 | |
| SCHEMBL4630746 | 0.83 | TACR2 (0.36) | TACR1TACR2TACR3 | |
| SCHEMBL4631251 | 0.82 | TACR1 (0.40) | TACR1TACR2TACR3 | |
| SCHEMBL4630039 | 0.79 | TACR1 (0.47) | TACR1TACR2TACR3 | |
| SCHEMBL4630844 | 0.78 | ADRB2 (0.37) | TACR1TACR2 | |
| SCHEMBL4631779 | 0.78 | TACR1 (0.63) | TACR1TACR2TACR3 | |
| SCHEMBL4630879 | 0.78 | TACR1 (0.46) | TACR1TACR2TACR3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6242637-B1 | USED IN TREATMENT INVOLVING THE TACHYKININ SYSTEM, SUCH AS PAIN, ALLERGY AND INFLAMMATION, CIRCULATORY, GASTROINTESTINAL, NEUROLOGICAL, AND NEUROPSYCHIATRIC DISORDERS | SANOFI-SYNTHELABO (FR) | 2001-06-05 | — | — | US | disclosed |
| US-6011154-A | Substituted heterocyclic compounds, method of preparing them and pharmaceutical compositions in which they are present | SANOFI (FR) | 2000-01-04 | — | — | US | disclosed |
| US-5977359-A | Substituted heterocyclic compounds, method of preparing them and pharmaceutical compositions in which they are present | SANOFI (FR) | 1999-11-02 | — | — | US | disclosed |
| US-5641777-A | NEUROKININ RECEPTOR ANTAGONIST | SANOFI (FR) | 1997-06-24 | — | — | US | disclosed |