Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 5/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 3/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7728140 | 1.00 | KCNH2 (0.48) | KCNH2MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL7727453 | 0.96 | KCNH2 (0.47) | KCNH2MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL7727456 | 0.96 | KCNH2 (0.47) | KCNH2MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL7732975 | 0.96 | KCNH2 (0.45) | KCNH2MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL7732972 | 0.96 | KCNH2 (0.45) | KCNH2MTNR1AMTNR1BCYP1A2 | |
| SCHEMBL7720732 | 0.96 | KCNH2 (0.46) | KCNH2MTNR1AMTNR1B | |
| SCHEMBL7720735 | 0.96 | KCNH2 (0.46) | KCNH2MTNR1AMTNR1B | |
| SCHEMBL7728104 | 0.96 | KCNH2 (0.46) | KCNH2MTNR1AMTNR1B | |
| SCHEMBL7728100 | 0.96 | KCNH2 (0.46) | KCNH2MTNR1AMTNR1B | |
| SCHEMBL7727546 | 0.96 | KCNH2 (0.49) | KCNH2MTNR1AMTNR1BCYP1A2 |
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 |