Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCHR1 | Q99705 | 5/20 | 0.43 |
| ▸ | ESR1 | P03372 | 9/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 9/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12440748 | 0.89 | MCHR1 (0.55) | MCHR1HTR2A | |
| SCHEMBL14767432 | 0.80 | KDM4E (0.44) | MCHR1ESR1ESR2CHEK1HTR2A | |
| SCHEMBL14767387 | 0.79 | ESR1 (0.63) | MCHR1ESR1ESR2HTR2A | |
| SCHEMBL12440496 | 0.79 | MCHR1 (0.55) | MCHR1HTR2A | |
| SCHEMBL12440019 | 0.79 | MCHR1 (0.55) | MCHR1HTR2AHTR2C | |
| SCHEMBL14767389 | 0.77 | ESR1 (0.60) | MCHR1ESR1ESR2HTR2A | |
| SCHEMBL14767412 | 0.76 | MCHR1 (0.52) | MCHR1HTR2A | |
| SCHEMBL14767429 | 0.76 | MCHR1 (0.46) | MCHR1HTR2A | |
| SCHEMBL12440267 | 0.76 | MCHR1 (0.67) | MCHR1HTR2A | |
| SCHEMBL14767414 | 0.74 | MCHR1 (0.56) | MCHR1HTR2C |
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-1558578-B1 | NOVEL ALKYNE COMPOUNDS HAVING AN MCH ANTAGONISTIC EFFECT AND MEDICAMENTS CONTAINING THESE COMPOUNDS | BOEHRINGER INGELHEIM PHARMA (DE) | 2013-03-13 | — | — | EP | disclosed |