Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL5543989 | 0.78 | TSHR (0.45) | CYP2D6 | |
| SCHEMBL5729059 | 0.73 | CHRM3 (0.49) | SIGMAR1 | |
| SCHEMBL1337898 | 0.73 | CA12 (0.48) | CYP2D6 | |
| SCHEMBL14761920 | 0.72 | SIGMAR1 (0.75) | SIGMAR1 | |
| SCHEMBL3025110 | 0.72 | CYP2D6 (0.90) | SIGMAR1CYP2D6 | |
| SCHEMBL2546084 | 0.72 | POLB (0.55) | SIGMAR1 | |
| SCHEMBL11355026 | 0.71 | CYP2D6 (0.87) | SIGMAR1CYP2D6 | |
| SCHEMBL11242236 | 0.71 | CYP2D6 (0.87) | SIGMAR1CYP2D6 | |
| Hydrochloric Acid SCHEMBL7971932 | 0.71 | CYP2D6 (0.87) | SIGMAR1CYP2D6 | |
| Hydrochloric Acid SCHEMBL7982262 | 0.71 | SIGMAR1 (0.73) | SIGMAR1 |
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-1060163-B1 | NEW PIPERAZINYL-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES | KLINGE CO CHEM PHARM FAB (DE) | 2005-10-12 | — | — | EP | disclosed |
| US-6903118-B1 | Piperazinyl-substituted pyridylalkane, alkene and alkine carboxamides | KLINGE PHARMA GMBH (DE) | 2005-06-07 | — | — | US | disclosed |
| EP-1060163-A1 | NEW PIPERAZINYL-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES | Klinge Pharma GmbH (DE) | 2000-12-20 | — | — | EP | disclosed |
| WO-1999031063-A1 | NEW PIPERAZINYL-SUBSTITUTED PYRIDYLALKANE, ALKENE AND ALKINE CARBOXAMIDES | KLINGE PHARMA GMBH (DE) | 1999-06-24 | — | — | WO | disclosed |