Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BDKRB1 | P46663 | 8/20 | 0.49 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | CCKBR | P32239 | 9/20 | 0.45 |
| ▸ | CCKAR | P32238 | 1/20 | 0.42 |
| ▸ | OXTR | P30559 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL8837727 | 0.92 | BDKRB1 (0.49) | BDKRB1KCNH2CCKBRCCKAROXTR | |
| SCHEMBL8837675 | 0.89 | KCNH2 (0.57) | KCNH2CCKBRCCKAR | |
| SCHEMBL9265881 | 0.82 | KCNH2 (0.62) | BDKRB1KCNH2CCKBROXTR | |
| SCHEMBL7816105 | 0.81 | CCKBR (0.69) | CCKBRCCKAR | |
| SCHEMBL7822689 | 0.81 | CCKBR (0.69) | CCKBRCCKAR | |
| SCHEMBL8837719 | 0.80 | KCNH2 (0.70) | KCNH2CCKBRCCKAR | |
| SCHEMBL8644964 | 0.79 | KCNH2 (0.58) | KCNH2CCKBRCCKAR | |
| SCHEMBL9286936 | 0.79 | KCNH2 (0.63) | KCNH2CCKBRCCKAROXTR | |
| SCHEMBL8745111 | 0.76 | KCNH2 (0.48) | KCNH2CCKBRCCKAROXTR | |
| SCHEMBL8623352 | 0.76 | KCNH2 (0.56) | KCNH2CCKBRCCKAR |
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-5428157-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1995-06-27 | — | — | US | disclosed |