Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | HTR2B | P41595 | 1/20 | 0.53 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.53 |
| ▸ | POLB | P06746 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.45 |
| ▸ | KCNK3 | O14649 | 1/20 | 0.44 |
| ▸ | KCNK9 | Q9NPC2 | 1/20 | 0.44 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | S1PR5 | Q9H228 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SCN4A | P35499 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9521625 | 0.86 | CYP2C9 (0.54) | CYP2C9CYP2C19HTR2BMAPK14HTT | |
| SCHEMBL10409320 | 0.85 | HSD11B1 (0.50) | HTTALDH1A1LMNAHSD11B1S1PR1 | |
| SCHEMBL9521948 | 0.82 | ALDH1A1 (0.50) | POLBALDH1A1LMNAS1PR1S1PR5 | |
| SCHEMBL1895069 | 0.81 | CYP2D6 (0.54) | HTTALDH1A1HSD11B1S1PR1S1PR5 | |
| SCHEMBL6318888 | 0.81 | S1PR5 (0.53) | HTTALDH1A1LMNAHSD11B1S1PR1 | |
| SCHEMBL16601135 | 0.78 | L3MBTL1 (0.46) | CYP2C9CYP2C19HTTALDH1A1LMNA | |
| Ambasilide SCHEMBL246531 | 0.77 | HSD11B1 (0.53) | ALDH1A1LMNAHSD11B1MEN1TSHR | |
| SCHEMBL9521802 | 0.77 | SIGMAR1 (0.50) | — | |
| SCHEMBL9521359 | 0.77 | KMT2A (0.58) | CYP2C19HTTALDH1A1LMNAHSD11B1 | |
| Ambasilide SCHEMBL427931 | 0.77 | HSD11B1 (0.53) | ALDH1A1LMNAHSD11B1MEN1TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0308843-B1 | Bispidin derivatives as class III antiarrhythmics | BASF AG (DE) | 1993-12-15 | — | — | EP | disclosed |
| US-4959373-A | Bispidine derivatives as class III antiarrhythmic agents | BASF AKTIENGESELLSCHAFT (DE) | 1990-09-25 | — | — | US | disclosed |
| EP-0308843-A2 | Bispidin derivatives as class III antiarrhythmics | BASF Aktiengesellschaft (DE) | 1989-03-29 | — | — | EP | disclosed |