Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR1 | P25103 | 19/20 | 0.57 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.56 |
| ▸ | PTAFR | P25105 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL6626769 | 0.87 | TACR1 (0.56) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL6600384 | 0.85 | TACR1 (0.79) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL3228336 | 0.82 | TACR1 (0.54) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL20530535 | 0.79 | CYP3A4 (0.49) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL5618546 | 0.79 | TACR1 (0.49) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL5618500 | 0.79 | TACR1 (0.49) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL5618497 | 0.79 | TACR1 (0.49) | TACR1SIGMAR1CYP3A4PTAFR | |
| SCHEMBL4398271 | 0.79 | TACR1 (0.54) | TACR1SIGMAR1CYP3A4 | |
| Hydrochloric Acid SCHEMBL5619955 | 0.78 | TACR1 (0.55) | TACR1SIGMAR1CYP3A4PTAFR | |
| Hydrochloric Acid SCHEMBL5619491 | 0.78 | TACR1 (0.55) | TACR1SIGMAR1CYP3A4PTAFR |
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-1472243-A1 | PIPERIDINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF TACHYKININS | GLAXO GROUP LIMITED (GB) | 2004-11-03 | — | — | EP | claimed |
| WO-2003066621-A1 | PIPERIDINE DERIVATIVES AND THEIR USE AS ANTAGONISTS OF TACHYKININS | GLAXO GROUP LIMITED (GB) | 2003-08-14 | — | — | WO | claimed |