Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 20/20 | 0.61 |
| ▸ | KCNH2 | Q12809 | 5/20 | 0.60 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.59 |
| ▸ | ADRA1A | P35348 | 4/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2661650 | 0.98 | HRH3 (0.63) | HRH3KCNH2CHRM2ADRA1A | |
| SCHEMBL15730882 | 0.85 | MKNK1 (0.48) | HRH3KCNH2CHRM2 | |
| SCHEMBL2313525 | 0.83 | HRH3 (0.55) | HRH3KCNH2CHRM2ADRA1A | |
| SCHEMBL18322843 | 0.80 | HRH3 (0.57) | HRH3KCNH2CHRM2ADRA1A | |
| SCHEMBL3794018 | 0.80 | HRH3 (0.62) | HRH3KCNH2CHRM2ADRA1A | |
| SCHEMBL2003521 | 0.76 | HRH3 (0.75) | HRH3KCNH2ADRA1A | |
| SCHEMBL2114527 | 0.75 | HRH3 (0.59) | HRH3KCNH2ADRA1A | |
| SCHEMBL2115507 | 0.75 | HRH3 (0.56) | HRH3KCNH2ADRA1A | |
| SCHEMBL1375874 | 0.75 | HRH3 (1.00) | HRH3KCNH2CHRM2ADRA1A | |
| SCHEMBL1375779 | 0.75 | HRH3 (1.00) | HRH3KCNH2CHRM2ADRA1A |
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-2010138343-A1 | NEUROMEDIN U RECEPTOR AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2010-12-02 | — | — | WO | disclosed |
| WO-2010071750-A1 | GLUCAGON RECEPTOR ANTAGONIST COMPOUNDS | MERCK SHARP & DOHME CORP. (US) | 2010-06-24 | — | — | WO | disclosed |