Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 2/20 | 0.59 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | HTR7 | P34969 | 1/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | PRMT5 | O14744 | 2/20 | 0.36 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.36 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9115512 | 0.88 | KCNH2 (0.76) | KCNH2 | |
| SCHEMBL9112284 | 0.88 | KCNH2 (0.47) | KCNH2HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL9113519 | 0.86 | HRH3 (0.44) | KCNH2HTR1AHTR7 | |
| Hydrochloric Acid SCHEMBL8831795 | 0.84 | KCNH2 (0.78) | KCNH2HTR1AHTR7HDAC3HDAC4 | |
| Hydrochloric Acid SCHEMBL8831789 | 0.84 | KCNH2 (0.78) | KCNH2HTR1AHTR7HDAC3HDAC4 | |
| SCHEMBL9115697 | 0.82 | ADRA1D (0.53) | KCNH2ADRA1D | |
| Hydrochloric Acid SCHEMBL8832001 | 0.79 | KCNH2 (0.83) | KCNH2 | |
| SCHEMBL9114263 | 0.78 | KCNH2 (0.38) | KCNH2HTR1AHTR7PRMT5WDR77 | |
| SCHEMBL9115004 | 0.78 | KCNH2 (0.40) | KCNH2HTR1AHTR7 | |
| Hydrochloric Acid SCHEMBL8832008 | 0.76 | KCNH2 (0.79) | KCNH2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1995014469-A1 | NOVEL SPIROCYCLES | MERCK & CO., INC. (US) | 1995-06-01 | — | — | WO | disclosed |
| US-5403846-A | Antiarrhythmic agents | MERCK & CO., INC. (US) | 1995-04-04 | — | — | US | disclosed |