Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOB | P27338 | 6/20 | 0.49 |
| ▸ | MAOA | P21397 | 4/20 | 0.49 |
| ▸ | CA12 | O43570 | 2/20 | 0.48 |
| ▸ | CA9 | Q16790 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 2/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.43 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.43 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.43 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.43 |
| ▸ | HRH2 | P25021 | 1/20 | 0.43 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR2A | P28223 | 1/20 | 0.43 |
| ▸ | HRH1 | P35367 | 1/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL27273851 | 0.88 | MEN1 (0.42) | MAOBMAOACA12CA9CA1 | |
| SCHEMBL8381918 | 0.88 | MAOB (0.51) | MAOBMAOACA12CA9POLB | |
| SCHEMBL8178252 | 0.85 | CA12 (0.51) | MAOBMAOACA12CA9POLB | |
| SCHEMBL282766 | 0.82 | CA12 (0.49) | MAOBMAOACA12CA9POLB | |
| SCHEMBL5606647 | 0.82 | MAOB (0.49) | MAOBMAOACA12CA9POLB | |
| SCHEMBL27922627 | 0.81 | MAOB (0.51) | MAOBMAOACA12CA9POLB | |
| SCHEMBL5711170 | 0.81 | CA12 (0.54) | MAOBMAOACA12CA9POLB | |
| SCHEMBL8420073 | 0.81 | CA12 (0.54) | MAOBMAOACA12CA9POLB | |
| SCHEMBL4013115 | 0.81 | MAOB (0.55) | MAOBMAOACA12CA9POLB | |
| SCHEMBL27841947 | 0.81 | MAOA (0.56) | MAOBMAOACA12CA9POLB |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1227543-A | Heterocyclylmethylamino derivatives of cyclobutene-3,4-diones as potassium channel modulators | AMERICAN HOME PROD (US) | 1999-09-01 | — | — | CN | disclosed |
| EP-0431943-B1 | Spiro(pyran)piperidine derivatives | MERCK & CO INC (US) | 1998-07-15 | — | — | EP | disclosed |
| US-5633247-A | ANTIARRTHYMIA AGENT | MERCK & CO., INC. (US) | 1997-05-27 | — | — | US | disclosed |
| US-5206240-A | Antiarrhythmia agents | MERCK & CO., INC. (US) | 1993-04-27 | — | — | US | disclosed |
| CN-1015804-B | METHOD FOR PREPARATION OF SULPHONIC ACID AMIDE COMPOUND FOR ANTIARRHYTHMIC AGENT | PFIZER LTD (GB) | 1992-03-11 | — | — | CN | disclosed |
| EP-0431943-A2 | Nitrogen-containing spirocycles | MERCK & CO. INC. (US) | 1991-06-12 | — | — | EP | disclosed |
| CN-1038451-A | Antiarrhythmics | PFIZER LTD (GB) | 1990-01-03 | — | — | CN | disclosed |