Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 19/20 | 0.64 |
| ▸ | PTAFR | P25105 | 1/20 | 0.64 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.64 |
| ▸ | CYP3A4 | P08684 | 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 | |
|---|---|---|---|---|
| SCHEMBL2484832 | 0.88 | TACR1 (0.77) | TACR1PTAFRSIGMAR1CYP3A4 | |
| SCHEMBL3245145 | 0.87 | TACR1 (0.66) | TACR1SIGMAR1CYP3A4 | |
| SCHEMBL4707782 | 0.87 | TACR1 (0.80) | TACR1PTAFRSIGMAR1CYP3A4 | |
| SCHEMBL4712181 | 0.87 | TACR1 (0.80) | TACR1PTAFRSIGMAR1CYP3A4 | |
| Hydrochloric Acid SCHEMBL4709532 | 0.86 | TACR1 (0.79) | TACR1PTAFRSIGMAR1CYP3A4 | |
| SCHEMBL3244347 | 0.86 | TACR1 (0.77) | TACR1SIGMAR1CYP3A4 | |
| SCHEMBL3247986 | 0.86 | TACR1 (0.77) | TACR1SIGMAR1CYP3A4 | |
| SCHEMBL25277637 | 0.83 | TACR1 (0.76) | TACR1PTAFRSIGMAR1CYP3A4 | |
| SCHEMBL4709667 | 0.82 | TACR1 (0.54) | TACR1PTAFRSIGMAR1 | |
| SCHEMBL2483424 | 0.80 | TACR1 (0.60) | TACR1PTAFRSIGMAR1CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1666465-B1 | Composition comprising a tachykinin receptor antagonist and a selective serotonin reuptake inhibitor | GLAXO GROUP LTD (GB) | 2008-05-07 | — | — | EP | claimed |