Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 9/20 | 0.57 |
| ▸ | CACNA1D | Q01668 | 9/20 | 0.57 |
| ▸ | CACNA1S | Q13698 | 9/20 | 0.57 |
| ▸ | CACNA1C | Q13936 | 9/20 | 0.57 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.56 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.56 |
| ▸ | CYP2C9 | P11712 | 5/20 | 0.56 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | TSHR | P16473 | 3/20 | 0.56 |
| ▸ | NFKB1 | P19838 | 3/20 | 0.56 |
| ▸ | LMNA | P02545 | 3/20 | 0.56 |
| ▸ | GMNN | O75496 | 1/20 | 0.56 |
| ▸ | BLM | P54132 | 1/20 | 0.56 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL11804560 | 0.97 | CACNA1F (0.62) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL10654578 | 0.88 | CYP1A2 (0.62) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL3062760 | 0.86 | CACNA1C (0.78) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL11804197 | 0.84 | CACNA1F (0.67) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL3443984 | 0.84 | CACNA1F (0.67) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL3443991 | 0.84 | CACNA1F (0.67) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL10731971 | 0.84 | CYP1A2 (0.76) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL11824768 | 0.83 | CACNA1F (0.84) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL16189736 | 0.83 | TSHR (0.66) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL11685375 | 0.83 | CYP1A2 (0.64) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 |
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-4048171-A | 1,4-Dihydropyridines | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-13 | — | — | US | claimed |
| US-4048171-A | 1,4-Dihydropyridines | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-13 | — | — | US | disclosed |