Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | EED | O75530 | 1/20 | 0.40 |
| ▸ | GBA1 | P04062 | 2/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 2/20 | 0.39 |
| ▸ | CHRNA4 | P43681 | 2/20 | 0.39 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.39 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Diphenylmethane SCHEMBL27274504 | 0.86 | HRH1 (0.45) | KMT2AALDH1A1GBA1 | |
| Toluene SCHEMBL17064224 | 0.83 | KMT2A (0.41) | KMT2A | |
| Ethylbenzene SCHEMBL27349792 | 0.82 | TP53 (0.45) | TP53KMT2AEEDGBA1CHRNB2 | |
| Ethylbenzene SCHEMBL27515696 | 0.81 | TP53 (0.52) | TP53KMT2AGBA1 | |
| Propane SCHEMBL28275444 | 0.80 | SLC6A1 (0.40) | KMT2AEED | |
| Butane SCHEMBL28225665 | 0.78 | SLC6A1 (0.39) | KMT2AEED | |
| Ethane SCHEMBL5894987 | 0.75 | — | — | |
| Methyl Alcohol SCHEMBL27559333 | 0.75 | — | — | |
| SCHEMBL13432 | 0.75 | — | — | |
| SCHEMBL11114 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101291913-A | Azinyl-3-sulfonylindazole derivatives as 5-hydroxytryptamine-6 ligands | WYETH CORP (US) | 2008-10-22 | — | — | CN | disclosed |