Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 6/20 | 0.88 |
| ▸ | KCNJ1 | P48048 | 5/20 | 0.88 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.47 |
| ▸ | MBTD1 | Q05BQ5 | 1/20 | 0.47 |
| ▸ | L3MBTL3 | Q96JM7 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | THRB | P10828 | 1/20 | 0.45 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.44 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9733460 | 0.85 | KCNJ1 (0.89) | KCNH2KCNJ1SIGMAR1HRH3 | |
| SCHEMBL297781 | 0.84 | KCNH2 (0.80) | KCNH2KCNJ1SIGMAR1 | |
| SCHEMBL9731809 | 0.83 | KCNJ1 (0.61) | KCNH2KCNJ1L3MBTL1ALDH1A1THRB | |
| Hydrochloric Acid SCHEMBL2731720 | 0.82 | KCNH2 (0.78) | KCNH2KCNJ1SIGMAR1 | |
| SCHEMBL9732081 | 0.82 | KCNH2 (0.61) | KCNH2KCNJ1 | |
| SCHEMBL2731338 | 0.82 | KCNH2 (0.76) | KCNH2KCNJ1SIGMAR1ALDH1A1NPSR1 | |
| Hydrochloric Acid SCHEMBL9733243 | 0.81 | KCNH2 (0.60) | KCNH2KCNJ1 | |
| SCHEMBL9732503 | 0.80 | KCNJ1 (0.56) | KCNH2KCNJ1SIGMAR1ALDH1A1NPSR1 | |
| SCHEMBL10233871 | 0.80 | KCNJ1 (1.00) | KCNH2KCNJ1SIGMAR1HRH3 | |
| SCHEMBL8564169 | 0.79 | KCNH2 (0.72) | KCNH2KCNJ1L3MBTL1L3MBTL3SIGMAR1 |
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-5112824-A | Benzofurazan compounds | MERCK & CO., INC. (US) | 1992-05-12 | — | — | US | disclosed |