Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM4 | P08173 | 1/20 | 0.55 |
| ▸ | CHRM3 | P20309 | 5/20 | 0.48 |
| ▸ | CHRM2 | P08172 | 4/20 | 0.46 |
| ▸ | RAMP1 | O60894 | 2/20 | 0.46 |
| ▸ | CALCRL | Q16602 | 2/20 | 0.46 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.45 |
| ▸ | CTSS | P25774 | 3/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | CALCA | P06881 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL5091174 | 0.88 | CHRM3 (0.58) | CHRM4CHRM3CHRM2SIGMAR1DRD2 | |
| SCHEMBL3958065 | 0.85 | CHRM4 (0.56) | CHRM4CHRM3CHRM2RAMP1CALCRL | |
| SCHEMBL5088985 | 0.81 | CHRM4 (0.58) | CHRM4CHRM3CHRM2RAMP1CALCRL | |
| SCHEMBL4607869 | 0.81 | MAPK1 (0.43) | CHRM4RAMP1CALCRLCALCA | |
| SCHEMBL2980917 | 0.79 | CTSS (0.57) | CHRM4CHRM3CHRM2CALCRLSIGMAR1 | |
| SCHEMBL9046543 | 0.78 | CHRM4 (0.70) | CHRM4CHRM3CHRM2RAMP1CALCRL | |
| SCHEMBL3596998 | 0.75 | CHRM4 (0.58) | CHRM4CHRM3CHRM2RAMP1CALCRL | |
| SCHEMBL3967246 | 0.75 | CHRM4 (0.65) | CHRM4CHRM3CHRM2RAMP1CALCRL | |
| SCHEMBL8126590 | 0.74 | OPRK1 (0.54) | CHRM3CHRM2SIGMAR1DRD4 | |
| SCHEMBL2262403 | 0.74 | CHRM3 (0.57) | CHRM3CHRM2SIGMAR1DRD2DRD4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1440976-B1 | Modified aminoacids, pharmaceuticals containing these compounds and method for their production | BOEHRINGER INGELHEIM PHARMA (DE) | 2008-07-23 | — | — | EP | disclosed |
| EP-1440976-A1 | Modified aminoacids, pharmaceuticals containing these compounds and method for their production | Boehringer Ingelheim Pharma GmbH & Co.KG (DE) | 2004-07-28 | — | — | EP | disclosed |
| EP-0927192-B1 | MODIFIED AMINOACIDS, PHARMACEUTICALS CONTAINING THESE COMPOUNDS AND METHOD FOR THEIR PRODUCTION | BOEHRINGER INGELHEIM PHARMA (DE) | 2004-05-12 | — | — | EP | disclosed |