Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.51 |
| ▸ | QDPR | P09417 | 1/20 | 0.50 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.46 |
| ▸ | TBXAS1 | P24557 | 1/20 | 0.46 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL9014298 | 0.84 | SIGMAR1 (0.48) | SIGMAR1CYP19A1TBXAS1KCNH2 | |
| SCHEMBL9014688 | 0.82 | KCNH2 (0.67) | SIGMAR1KCNH2 | |
| SCHEMBL9014648 | 0.79 | KCNH2 (0.66) | SIGMAR1KCNH2 | |
| Bromide SCHEMBL10407846 | 0.78 | KCNH2 (0.68) | SIGMAR1QDPRKCNH2 | |
| Hydrochloric Acid SCHEMBL7653299 | 0.77 | SIGMAR1 (0.63) | SIGMAR1CYP19A1TBXAS1 | |
| SCHEMBL9014375 | 0.75 | KCNH2 (0.70) | SIGMAR1QDPRKCNH2 | |
| SCHEMBL7403278 | 0.74 | ALDH1A1 (0.59) | SIGMAR1CYP19A1TBXAS1 | |
| Hydrochloric Acid SCHEMBL7401194 | 0.73 | ALDH1A1 (0.58) | SIGMAR1CYP19A1TBXAS1 | |
| SCHEMBL4108931 | 0.72 | DRD2 (0.54) | SIGMAR1CYP19A1TBXAS1KCNH2 | |
| Oxalic Acid SCHEMBL4102634 | 0.70 | DRD2 (0.48) | SIGMAR1CYP19A1TBXAS1KCNH2 |
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 |
|---|---|---|---|---|---|---|---|
| US-5495022-A | Piperidines and piperazines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1996-02-27 | — | — | US | disclosed |
| EP-0634398-A1 | 4-Phenylpiperidinyl-1/-piperazinyl-1-ethylsubstituted benzofusedheterocycles as antiarrhythmic agents | MERCK PATENT GmbH (DE) | 1995-01-18 | — | — | EP | disclosed |