Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.53 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.48 |
| ▸ | NPY1R | P25929 | 1/20 | 0.48 |
| ▸ | NPY2R | P49146 | 1/20 | 0.48 |
| ▸ | PDE3B | Q13370 | 10/20 | 0.47 |
| ▸ | PDE3A | Q14432 | 9/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | PDE4A | P27815 | 3/20 | 0.44 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.44 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.44 |
| ▸ | PDE4D | Q08499 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10465918 | 0.95 | KCNH2 (0.56) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10474199 | 0.86 | LMNA (0.62) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10464834 | 0.80 | LMNA (0.50) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL21970671 | 0.78 | KCNH2 (0.61) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10464942 | 0.77 | LMNA (0.52) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10463518 | 0.77 | LMNA (0.44) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10463519 | 0.77 | LMNA (0.44) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10464826 | 0.76 | LMNA (0.45) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10464825 | 0.76 | LMNA (0.45) | KCNH2SMN1; SMN2LMNANPY1RNPY2R | |
| SCHEMBL10353452 | 0.75 | SMN1; SMN2 (0.81) | KCNH2SMN1; SMN2LMNANPY1RNPY2R |
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-4898865-A | FOR CIRCULATORY DISEASES, THROMBOSES | BAYER AKTIENGESELLSCHAFT (DE) | 1990-02-06 | — | — | US | disclosed |
| EP-0308608-A1 | Substituted nitro-dihydropyridines, process for their preparation and their use | BAYER AG (DE) | 1989-03-29 | — | — | EP | disclosed |