Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 3/20 | 0.55 |
| ▸ | TACR1 | P25103 | 18/20 | 0.52 |
| ▸ | TACR2 | P21452 | 1/20 | 0.46 |
| ▸ | TACR3 | P29371 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8840258 | 0.98 | CCR5 (0.54) | CCR5TACR1TACR2TACR3 | |
| Hydrochloric Acid SCHEMBL8483405 | 0.98 | CCR5 (0.54) | CCR5TACR1TACR2TACR3 | |
| SCHEMBL8991959 | 0.92 | TACR1 (0.63) | CCR5TACR1TACR2TACR3 | |
| SCHEMBL22901986 | 0.92 | TACR1 (0.63) | CCR5TACR1TACR2TACR3 | |
| Hydrochloric Acid SCHEMBL8840357 | 0.91 | TACR1 (0.62) | CCR5TACR1TACR2TACR3 | |
| SCHEMBL4631735 | 0.88 | TACR1 (0.47) | CCR5TACR1TACR2TACR3 | |
| Hydrochloric Acid SCHEMBL7749200 | 0.86 | TACR1 (0.46) | CCR5TACR1TACR2TACR3 | |
| Hydrochloric Acid SCHEMBL7749206 | 0.86 | TACR1 (0.46) | CCR5TACR1TACR2TACR3 | |
| SCHEMBL7764193 | 0.86 | TACR1 (0.72) | CCR5TACR1TACR2TACR3 | |
| Hydrochloric Acid SCHEMBL8480218 | 0.85 | TACR1 (0.71) | CCR5TACR1TACR2TACR3 |
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-1101757-A1 | Heterocyclic compounds as tachykinin receptor antagonists | SANOFI-SYNTHELABO (FR) | 2001-05-23 | — | — | EP | disclosed |
| EP-0723959-A1 | Heterocyclic compounds as tachykinin receptor antagonists, process for their preparation and pharmaceuticals containing them | SANOFI (FR) | 1996-07-31 | — | — | EP | disclosed |