Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.49 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL779822 | 0.83 | CYP3A4 (0.46) | DPP4CHRNA7 | |
| Hydrochloric Acid SCHEMBL780022 | 0.82 | CYP3A4 (0.45) | DPP4KCNH2 | |
| SCHEMBL779797 | 0.80 | CHRNA7 (0.58) | CHRNA7KCNH2 | |
| SCHEMBL780140 | 0.80 | CHRNA7 (0.61) | CHRNA7KCNH2 | |
| SCHEMBL779527 | 0.80 | CHRNA7 (0.58) | CHRNA7KCNH2 | |
| Hydrochloric Acid SCHEMBL780116 | 0.80 | KCNH2 (0.59) | CHRNA7KCNH2 | |
| Hydrochloric Acid SCHEMBL780046 | 0.80 | KCNH2 (0.59) | CHRNA7KCNH2 | |
| Hydrochloric Acid SCHEMBL779438 | 0.80 | KCNH2 (0.61) | CHRNA7KCNH2 | |
| SCHEMBL778271 | 0.79 | CHRNA7 (0.74) | CHRNA7KCNH2 | |
| Hydrochloric Acid SCHEMBL16241566 | 0.79 | KCNH2 (0.51) | CHRNA7KCNH2 |
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-2044038-A2 | NOVEL PIPERAZINES, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF | Cornerstone Therapeutics Inc. (US) | 2009-04-08 | — | — | EP | claimed |
| WO-2007146066-A2 | NOVEL PIPERAZINES, PHARMACEUTICAL COMPOSITIONS AND METHODS OF USE THEREOF | CRITICAL THERAPEUTICS, INC. (US) | 2007-12-21 | — | — | WO | claimed |