Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.38 |
| ▸ | HTR2A | P28223 | 2/20 | 0.38 |
| ▸ | MCHR1 | Q99705 | 2/20 | 0.38 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.38 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.37 |
| ▸ | DGAT1 | O75907 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.36 |
| ▸ | SLC6A2 | P23975 | 4/20 | 0.36 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.36 |
| ▸ | MITF | O75030 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 4/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL12440742 | 0.94 | KDM1A (0.42) | KDM1AMAOBCHRM1HTR2AMCHR1 | |
| SCHEMBL5226871 | 0.83 | MCHR1 (0.59) | CHRM1HTR2AMCHR1HRH3 | |
| SCHEMBL5227157 | 0.78 | MCHR1 (0.57) | CHRM1HTR2AMCHR1 | |
| SCHEMBL12440550 | 0.76 | MAOB (0.40) | KDM1AMAOBCHRM1HTR2AMCHR1 | |
| SCHEMBL12440597 | 0.75 | CNR2 (0.49) | MCHR1DGAT1CNR2 | |
| SCHEMBL12441406 | 0.74 | MAOB (0.39) | KDM1AMAOBCHRM1HTR2AMCHR1 | |
| SCHEMBL5225518 | 0.73 | MCHR1 (0.49) | CHRM1HTR2AMCHR1 | |
| SCHEMBL18790890 | 0.72 | NPC1 (0.45) | KDM1ADGAT1RAB9A | |
| SCHEMBL5262930 | 0.71 | MCHR1 (0.47) | CHRM1HTR2AMCHR1 | |
| SCHEMBL20924267 | 0.70 | KDM1A (0.64) | KDM1AMAOBDGAT1RAB9ACNR2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2357173-A1 | New alkyne compounds with MCH-antagonistic activity and medicaments containing them | Boehringer Ingelheim Pharma GmbH & Co. KG (DE) | 2011-08-17 | — | — | EP | disclosed |