Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1D | Q01668 | 15/20 | 0.77 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | DHFR | P00374 | 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 | |
|---|---|---|---|---|
| SCHEMBL11800038 | 0.89 | CACNA1D (0.62) | CACNA1D | |
| SCHEMBL11795742 | 0.86 | CACNA1D (0.58) | CACNA1DADORA3KDM4EGAA | |
| SCHEMBL11799255 | 0.86 | CACNA1D (0.60) | CACNA1DADORA3KDM4EGAADHFR | |
| SCHEMBL11798629 | 0.85 | CACNA1D (0.65) | CACNA1DADORA3 | |
| SCHEMBL11669396 | 0.78 | ADORA3 (0.68) | CACNA1DADORA3KDM4EGAADHFR | |
| SCHEMBL9872262 | 0.76 | CACNA1D (1.00) | CACNA1DADORA3 | |
| SCHEMBL11691626 | 0.75 | ADORA3 (0.56) | CACNA1DADORA3KDM4EGAA | |
| SCHEMBL11691621 | 0.75 | ADORA3 (0.56) | CACNA1DADORA3KDM4EGAA | |
| SCHEMBL10684386 | 0.75 | ADORA3 (0.75) | CACNA1DADORA3KDM4EGAADHFR | |
| SCHEMBL9873467 | 0.74 | CACNA1D (0.80) | CACNA1DADORA3 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-3989708-A | HYPOTENSIVE, CORONARY VESSEL DILATORS | BAYER AKTIENGESELLSCHAFT (DT) | 1976-11-02 | — | — | US | disclosed |