Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 14/20 | 0.57 |
| ▸ | TACR1 | P25103 | 8/20 | 0.57 |
| ▸ | TACR2 | P21452 | 6/20 | 0.57 |
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8972912 | 0.95 | TACR3 (0.52) | TACR3TACR1TACR2 | |
| SCHEMBL8969406 | 0.84 | TACR3 (0.51) | TACR3TACR1TACR2 | |
| SCHEMBL8969610 | 0.80 | TACR3 (0.57) | TACR3TACR1TACR2CCR5 | |
| SCHEMBL8561467 | 0.79 | TACR1 (0.52) | TACR3TACR1TACR2CCR5 | |
| SCHEMBL4630836 | 0.79 | TACR3 (0.58) | TACR3TACR1TACR2CCR5 | |
| Hydrochloric Acid SCHEMBL7744611 | 0.78 | TACR3 (0.57) | TACR3TACR1TACR2CCR5 | |
| SCHEMBL4630229 | 0.78 | TACR3 (0.52) | TACR3TACR1TACR2 | |
| SCHEMBL4630026 | 0.77 | TACR3 (0.51) | TACR3TACR1TACR2 | |
| Hydrochloric Acid SCHEMBL7750409 | 0.77 | TACR3 (0.51) | TACR3TACR1TACR2 | |
| SCHEMBL8973884 | 0.77 | TACR2 (0.57) | TACR3TACR1TACR2 |
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 |
|---|---|---|---|---|---|---|---|
| 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 |