Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | TACR2 | P21452 | 6/20 | 0.39 |
| ▸ | CCR5 | P51681 | 2/20 | 0.32 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.32 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.32 |
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 SCHEMBL8953696 | 0.99 | TACR1 (0.39) | TACR1TACR2CCR5MCHR1SLC6A2 | |
| SCHEMBL8315849 | 0.87 | TACR1 (0.43) | TACR1TACR2CCR5 | |
| SCHEMBL8315878 | 0.87 | TACR1 (0.39) | TACR1TACR2CCR5FDFT1 | |
| Hydrochloric Acid SCHEMBL8953619 | 0.86 | TACR1 (0.42) | TACR1TACR2CCR5 | |
| SCHEMBL8314053 | 0.83 | TACR1 (0.37) | TACR1TACR2CCR5FDFT1 | |
| Hydrochloric Acid SCHEMBL8953818 | 0.80 | CCR5 (0.37) | TACR1TACR2CCR5 | |
| SCHEMBL8592468 | 0.79 | TACR1 (0.40) | TACR1TACR2CCR5FDFT1 | |
| SCHEMBL8592517 | 0.76 | TACR1 (0.38) | TACR1TACR2CCR5FDFT1 | |
| SCHEMBL8591139 | 0.75 | TACR1 (0.42) | TACR1TACR2CCR5SLC6A3 | |
| SCHEMBL8314434 | 0.75 | CCR5 (0.48) | TACR1TACR2CCR5 |
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-0591040-B1 | Quaternary basic amides as tachykinines antagonists | SANOFI SA (FR) | 1999-02-03 | — | — | EP | disclosed |
| EP-0591040-A1 | Quaternary basic amides as tachykinines antagonists | SANOFI (FR) | 1994-04-06 | — | — | EP | disclosed |