Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM3 | P20309 | 3/20 | 0.55 |
| ▸ | CHRM2 | P08172 | 2/20 | 0.55 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.55 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.55 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | THRB | P10828 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
| ▸ | MCOLN3 | Q8TDD5 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.35 |
| ▸ | THPO | P40225 | 1/20 | 0.35 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | HRH1 | P35367 | 1/20 | 0.34 |
| ▸ | HTR2B | P41595 | 1/20 | 0.34 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2420231 | 0.79 | CHRM3 (0.58) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL3729307 | 0.78 | CHRM3 (0.56) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL7678364 | 0.75 | LMNA (0.52) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL22124338 | 0.74 | LMNA (0.51) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL14339677 | 0.72 | CHRM3 (0.52) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL8175852 | 0.72 | SMN1; SMN2 (0.51) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| Arecoline SCHEMBL44065 | 0.72 | CHRM2 (1.00) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| Arecoline SCHEMBL3057863 | 0.70 | CHRM2 (0.96) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| Arecoline SCHEMBL527735 | 0.70 | BLM (1.00) | CHRM3CHRM2CHRM4CHRM5CHRM1 | |
| SCHEMBL15569637 | 0.68 | PTPN1 (0.41) | CHRM3CHRM2CHRM4CHRM5CHRM1 |
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-0459568-A2 | Substituted oxadiazoles and thiadiazoles for use in the treatment of glaucoma and novel compounds having such use | MERCK SHARP & DOHME LTD. (GB) | 1991-12-04 | — | — | EP | disclosed |
| EP-0323864-A2 | Lipophilic oxadiazoles | MERCK SHARP & DOHME LTD. (GB) | 1989-07-12 | — | — | EP | disclosed |