Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 4/20 | 0.57 |
| ▸ | CCKBR | P32239 | 10/20 | 0.56 |
| ▸ | CCKAR | P32238 | 4/20 | 0.52 |
| ▸ | NOTCH1 | P46531 | 1/20 | 0.52 |
| ▸ | NOTCH3 | Q9UM47 | 1/20 | 0.52 |
| ▸ | PSEN1 | P49768 | 2/20 | 0.51 |
| ▸ | PSEN2 | P49810 | 2/20 | 0.51 |
| ▸ | APH1B | Q8WW43 | 2/20 | 0.51 |
| ▸ | NCSTN | Q92542 | 2/20 | 0.51 |
| ▸ | APH1A | Q96BI3 | 2/20 | 0.51 |
| ▸ | PSENEN | Q9NZ42 | 2/20 | 0.51 |
| ▸ | GSAP | A4D1B5 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL8761200 | 1.00 | KCNH2 (0.57) | KCNH2CCKBRCCKARNOTCH1NOTCH3 | |
| SCHEMBL8761227 | 0.93 | KCNH2 (0.59) | KCNH2CCKBRCCKARNOTCH1NOTCH3 | |
| SCHEMBL8760328 | 0.91 | CCKBR (0.59) | KCNH2CCKBRCCKARPSEN1PSEN2 | |
| SCHEMBL8761602 | 0.88 | CCKBR (0.57) | KCNH2CCKBRPSEN1PSEN2APH1B | |
| SCHEMBL8760279 | 0.87 | KCNH2 (0.60) | KCNH2CCKBRPSEN1PSEN2APH1B | |
| SCHEMBL8760273 | 0.87 | KCNH2 (0.75) | KCNH2CCKBRCCKARNOTCH1NOTCH3 | |
| SCHEMBL8466302 | 0.85 | KCNH2 (0.76) | KCNH2CCKBR | |
| SCHEMBL8761096 | 0.83 | OXTR (0.58) | KCNH2CCKBRCCKARPSEN1PSEN2 | |
| SCHEMBL8760280 | 0.83 | OXTR (0.58) | KCNH2CCKBRCCKARPSEN1PSEN2 | |
| SCHEMBL8761391 | 0.83 | KCNH2 (0.61) | KCNH2CCKBRCCKARGSAP |
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-2002099388-A2 | BENZODIAZEPINE BRADYKININ ANTAGONISTS | MERCK & CO., INC. (US) | 2002-12-12 | — | — | WO | claimed |
| WO-2002099388-A2 | BENZODIAZEPINE BRADYKININ ANTAGONISTS | MERCK & CO., INC. (US) | 2002-12-12 | — | — | WO | disclosed |