Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 19/20 | 0.64 |
| ▸ | TACR2 | P21452 | 2/20 | 0.53 |
| ▸ | TACR3 | P29371 | 2/20 | 0.53 |
| ▸ | CCR5 | P51681 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8559009 | 0.88 | TACR1 (0.53) | TACR1TACR2TACR3 | |
| SCHEMBL8203185 | 0.80 | TACR1 (0.68) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7819383 | 0.79 | TACR1 (0.62) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL8561467 | 0.79 | TACR1 (0.52) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7306896 | 0.79 | TACR1 (1.00) | TACR1TACR2TACR3CCR5 | |
| Hydrochloric Acid SCHEMBL7751634 | 0.78 | TACR1 (0.98) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL4680438 | 0.77 | KDM4E (0.70) | TACR1 | |
| SCHEMBL30596349 | 0.77 | KDM4E (0.70) | TACR1 | |
| SCHEMBL8969668 | 0.75 | KDM4E (0.60) | TACR1 | |
| Hydrochloric Acid SCHEMBL8563831 | 0.74 | KDM4E (0.62) | TACR1 |
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-5726313-A | Substituted arylaliphatic compounds, method of preparing them and pharmaceutical compositions in which they are present | SANOFI (FR) | 1998-03-10 | — | — | US | disclosed |
| EP-0700386-A1 | NEUROKININ RECEPTOR ANTAGONISTS | SANOFI (FR) | 1996-03-13 | — | — | EP | disclosed |
| WO-1995026338-A1 | NEUROKININ RECEPTOR ANTAGONISTS | SANOFI (FR) | 1995-10-05 | — | — | WO | disclosed |