Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 11/20 | 0.48 |
| ▸ | CACNA1D | Q01668 | 11/20 | 0.48 |
| ▸ | CACNA1S | Q13698 | 11/20 | 0.48 |
| ▸ | CACNA1C | Q13936 | 11/20 | 0.48 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.48 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7888022 | 0.88 | TSHR (0.50) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL30044577 | 0.88 | TSHR (0.50) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| Hydrochloric Acid SCHEMBL28628233 | 0.86 | TSHR (0.49) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL7372793 | 0.83 | CACNA1C (0.40) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL7416605 | 0.77 | LMNA (0.46) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL10514933 | 0.76 | HIF1A (0.54) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL7372790 | 0.75 | CACNA1C (0.40) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL7372786 | 0.73 | ALDH1A1 (0.40) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL11440424 | 0.72 | CACNA1C (0.44) | CACNA1FCACNA1DCACNA1SCACNA1CADORA3 | |
| SCHEMBL7420762 | 0.72 | CACNA1F (0.54) | 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 |
|---|---|---|---|---|---|---|---|
| WO-1988005043-A1 | NEW ARALKYL-1,4-DIHYDROPYRIDINES, A METHOD FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1988-07-14 | — | — | WO | disclosed |
| EP-0272693-A2 | New aralkyl-1,4-dihydropyridines, a method for their preparation and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1988-06-29 | — | — | EP | disclosed |