Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.38 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.38 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.38 |
| ▸ | KCNQ3 | O43525 | 2/20 | 0.36 |
| ▸ | KCNQ2 | O43526 | 2/20 | 0.36 |
| ▸ | KCNQ4 | P56696 | 1/20 | 0.36 |
| ▸ | KCNQ5 | Q9NR82 | 1/20 | 0.36 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL10682240 | 0.87 | KCNQ3 (0.37) | CHRM2CHRM4CHRM3KCNQ3KCNQ2 | |
| SCHEMBL16618191 | 0.87 | KCNQ3 (0.37) | CHRM2CHRM4CHRM3KCNQ3KCNQ2 | |
| SCHEMBL16617896 | 0.82 | KCNQ3 (0.37) | CHRM2CHRM4CHRM3KCNQ3KCNQ2 | |
| SCHEMBL16637758 | 0.82 | KCNQ3 (0.37) | CHRM2CHRM4CHRM3KCNQ3KCNQ2 | |
| SCHEMBL18279798 | 0.81 | CHRM2 (0.35) | CHRM2CHRM4CHRM3KCNQ3KCNQ2 | |
| SCHEMBL17008630 | 0.81 | CHRM2 (0.35) | CHRM2CHRM4CHRM3KCNQ3KCNQ2 | |
| SCHEMBL24174889 | 0.80 | CHRM2 (0.36) | CHRM2CHRM4CHRM3ALDH1A1CYP1A2 | |
| SCHEMBL17756086 | 0.80 | CHRM2 (0.36) | CHRM2CHRM4CHRM3ALDH1A1CYP1A2 | |
| SCHEMBL15684140 | 0.80 | CHRM2 (0.36) | CHRM2CHRM4CHRM3ALDH1A1CYP1A2 | |
| SCHEMBL26656187 | 0.80 | CHRM2 (0.36) | CHRM2CHRM4CHRM3ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3104705-B1 | CATHEPSIN CYSTEINE PROTEASE INHIBITORS | MERCK SHARP & DOHME (US) | 2021-11-03 | — | — | EP | disclosed |
| US-9656990-B2 | Cathepsin cysteine protease inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-05-23 | — | — | US | disclosed |