Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL16424463 | 0.78 | ALDH1A1 (0.36) | — | |
| SCHEMBL11886190 | 0.77 | CYP1A2 (0.31) | CYP1A2KDM4EKMT2A | |
| SCHEMBL27447235 | 0.76 | CYP1A2 (0.32) | CYP1A2KDM4EKMT2A | |
| Ammonia Solution, Strong SCHEMBL10792221 | 0.76 | ALDH1A1 (0.33) | — | |
| SCHEMBL16111870 | 0.74 | CYP1A2 (0.32) | CYP1A2KDM4EKMT2A | |
| SCHEMBL17376007 | 0.73 | L3MBTL1 (0.32) | — | |
| SCHEMBL9614017 | 0.73 | L3MBTL1 (0.32) | — | |
| Isopropyl Alcohol SCHEMBL15641452 | 0.71 | — | — | |
| SCHEMBL17376021 | 0.71 | L3MBTL1 (0.31) | — | |
| SCHEMBL17376013 | 0.71 | L3MBTL1 (0.31) | — |
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-1142184-A | Antiarrhythmic benzodiazepines * | MERCK & CO INC (US) | 1997-02-05 | — | — | CN | disclosed |