Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 6/20 | 0.49 |
| ▸ | CACNA1D | Q01668 | 6/20 | 0.49 |
| ▸ | CACNA1S | Q13698 | 6/20 | 0.49 |
| ▸ | CACNA1C | Q13936 | 6/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 3/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | NR3C1 | P04150 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 2/20 | 0.46 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.46 |
| ▸ | CNR1 | P21554 | 2/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | SCN1A | P35498 | 2/20 | 0.46 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.46 |
| ▸ | SCN5A | Q14524 | 2/20 | 0.46 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.46 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.46 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6942341 | 1.00 | CACNA1F (0.49) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL6942336 | 0.97 | CACNA1F (0.47) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL6942347 | 0.97 | CACNA1F (0.47) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL6945825 | 0.97 | CACNA1F (0.47) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL9765691 | 0.81 | ABCB11 (0.59) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL3032439 | 0.81 | MTOR (0.59) | CACNA1CCYP1A2NR1I2ADORA3ABCB11 | |
| SCHEMBL13285115 | 0.79 | CYP2C9 (0.67) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL6945817 | 0.78 | ALOX15 (0.51) | CYP1A2NR1I2ADORA3ABCB11LMNA | |
| SCHEMBL7884089 | 0.78 | NR1I2 (0.59) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 | |
| SCHEMBL9765739 | 0.78 | CACNA1D (0.68) | CACNA1FCACNA1DCACNA1SCACNA1CCYP1A2 |
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-0657431-B1 | 4-Phenyl-3-substituted 1,4-dihydropyridine esters with cerebral activity | BAYER AG (DE) | 2003-02-19 | — | — | EP | claimed |
| US-6066655-A | FOR THE TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, IN PARTICULAR AS CEREBRAL THERAPEUTICS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-05-23 | — | — | US | disclosed |
| US-5731333-A | LEARNING AND MEMORY ENHANCEMENT, ANTIDEPRESSANTS | BAYER AKTIENGESELLSCHAFT (DE) | 1998-03-24 | — | — | US | disclosed |