Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 18/20 | 0.68 |
| ▸ | TACR2 | P21452 | 3/20 | 0.67 |
| ▸ | TACR3 | P29371 | 1/20 | 0.67 |
| ▸ | CCR5 | P51681 | 2/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL8351334 | 0.93 | TACR1 (0.66) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL8807306 | 0.85 | TACR1 (0.63) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL8355624 | 0.82 | TACR1 (0.52) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7770397 | 0.81 | TACR1 (0.75) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7764193 | 0.81 | TACR1 (0.72) | TACR1TACR2TACR3CCR5 | |
| Hydrochloric Acid SCHEMBL8483004 | 0.81 | TACR1 (0.74) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7306896 | 0.81 | TACR1 (1.00) | TACR1TACR2TACR3CCR5 | |
| Hydrochloric Acid SCHEMBL8480218 | 0.81 | TACR1 (0.71) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7956540 | 0.80 | CCR5 (0.58) | TACR1TACR2TACR3CCR5 | |
| SCHEMBL7841995 | 0.80 | TACR2 (0.58) | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5861416-A | TREATMENT OF ASTHMA OR COUGH | MERRELL PHARMACEUTICALS INC. (US) | 1999-01-19 | — | — | US | disclosed |