Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CCR8 | P51685 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL7728077 | 0.97 | KCNH2 (0.44) | KCNH2CYP1A2CCR8 | |
| SCHEMBL7729162 | 0.94 | KCNH2 (0.47) | KCNH2CYP1A2 | |
| SCHEMBL7721660 | 0.94 | KCNH2 (0.47) | KCNH2CYP1A2CCR8 | |
| SCHEMBL7721659 | 0.94 | KCNH2 (0.47) | KCNH2CYP1A2CCR8 | |
| SCHEMBL7731049 | 0.92 | KCNH2 (0.48) | KCNH2 | |
| SCHEMBL7720856 | 0.92 | KCNH2 (0.48) | KCNH2CYP1A2CCR8 | |
| SCHEMBL7725278 | 0.92 | KCNH2 (0.48) | KCNH2CYP1A2CCR8 | |
| SCHEMBL7731986 | 0.92 | KCNH2 (0.47) | KCNH2 | |
| SCHEMBL7731378 | 0.92 | KCNH2 (0.57) | KCNH2 | |
| SCHEMBL6606641 | 0.92 | KCNH2 (0.45) | KCNH2CCR8 |
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-6403610-B1 | ANTIMICROBIAL AGENTS | AVENTIS PHARMA S.A. (FR) | 2002-06-11 | — | — | US | disclosed |