Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 3/20 | 0.64 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.64 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.64 |
| ▸ | ACHE | P22303 | 3/20 | 0.64 |
| ▸ | BCHE | P06276 | 3/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.52 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.50 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL18114970 | 0.87 | CHRM2 (0.77) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| SCHEMBL29351421 | 0.84 | CHRM2 (0.62) | CHRM2CHRM1CHRM3BCHEKDM4E | |
| SCHEMBL28696933 | 0.84 | CHRM2 (0.62) | CHRM2CHRM1CHRM3BCHEKDM4E | |
| SCHEMBL2759534 | 0.82 | CHRM2 (0.70) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| SCHEMBL9517424 | 0.82 | CHRM2 (0.70) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| SCHEMBL10645373 | 0.81 | CHRM2 (0.68) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| SCHEMBL15681916 | 0.81 | CHRM2 (0.68) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| Bromide SCHEMBL9649046 | 0.81 | CHRM2 (0.68) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| SCHEMBL6896901 | 0.80 | CHRM2 (0.72) | CHRM2CHRM1CHRM3BCHETAAR1 | |
| SCHEMBL5703462 | 0.80 | TAAR1 (0.61) | CHRM2CHRM1CHRM3TAAR1MTNR1A |
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-2061449-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | Leo Pharma A/S (DK) | 2009-05-27 | — | — | EP | disclosed |
| WO-2008019690-A1 | SUBSTITUTED ACETYLENIC COMPOUNDS USEFUL FOR THE TREATMENT OF DISEASES | LEO PHARMA A/S (DK) | 2008-02-21 | — | — | WO | disclosed |