Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.67 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.63 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.56 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.54 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.53 |
| ▸ | MAOA | P21397 | 1/20 | 0.52 |
| ▸ | MAOB | P27338 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL493570 | 0.85 | SIGMAR1 (0.58) | SIGMAR1OPRM1 | |
| SCHEMBL12023880 | 0.82 | SIGMAR1 (0.75) | SIGMAR1HRH3HTR1ASLC6A4 | |
| SCHEMBL19609684 | 0.81 | HRH1 (0.53) | KCNJ1KCNH2OPRM1 | |
| SCHEMBL4069868 | 0.81 | HTR2A (0.59) | KCNJ1KCNH2 | |
| SCHEMBL10499190 | 0.81 | SIGMAR1 (0.73) | SIGMAR1HRH3KCNJ1KCNH2HTR1A | |
| SCHEMBL7829844 | 0.80 | ACHE (0.63) | SIGMAR1KCNH2 | |
| SCHEMBL3590279 | 0.80 | SIGMAR1 (0.58) | SIGMAR1HRH3KCNJ1KCNH2HTR1A | |
| Hydrochloric Acid SCHEMBL8502542 | 0.79 | HTR2A (0.58) | KCNJ1KCNH2 | |
| SCHEMBL7841889 | 0.79 | SIGMAR1 (0.65) | SIGMAR1HRH3KCNJ1KCNH2HTR1A | |
| SCHEMBL3590284 | 0.79 | SIGMAR1 (0.60) | SIGMAR1HRH3KCNJ1KCNH2HTR1A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5739150-A | Piperidinyl thiacyclic derivatives | MERRELL PHARMACEUTICALS INC. (US) | 1998-04-14 | — | — | US | disclosed |
| EP-0626968-A4 | — | — | 1995-01-04 | — | — | EP | disclosed |
| EP-0626968-A1 | PIPERIDINYL THIACYCLIC DERIVATIVES | MERRELL PHARMACEUTICALS INC. (US) | 1994-12-07 | — | — | EP | disclosed |