Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 19/20 | 0.63 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.60 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.60 |
| ▸ | PTAFR | P25105 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL4703855 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4031477 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4473420 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4703854 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4483237 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4483233 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4473417 | 1.00 | TACR1 (0.63) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL20599311 | 0.88 | TACR1 (0.68) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL4023770 | 0.88 | TACR1 (0.61) | TACR1CYP3A4SIGMAR1PTAFR | |
| SCHEMBL18947362 | 0.84 | TACR1 (0.69) | TACR1CYP3A4SIGMAR1PTAFR |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1460066-B1 | Piperazine compounds as Tachykinins inhibitors | GLAXO GROUP LTD (GB) | 2009-07-01 | — | — | EP | disclosed |
| EP-1454901-B1 | Pharmaceutical compositions comprising tachykinins antagonists and a serotonin reuptake inhibitor. | GLAXO GROUP LTD (GB) | 2008-09-03 | — | — | EP | disclosed |
| EP-1460066-A1 | Piperazine compounds | GLAXO GROUP LIMITED (GB) | 2004-09-22 | — | — | EP | disclosed |
| EP-1454901-A1 | Piperazine compounds and pharmaceutical compositions containing them. | GLAXO GROUP LIMITED (GB) | 2004-09-08 | — | — | EP | disclosed |