Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA1F | O60840 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.40 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | DRD1 | P21728 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | TACR1 | P25103 | 1/20 | 0.40 |
| ▸ | PTAFR | P25105 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.40 |
| ▸ | GNRHR | P30968 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4229028 | 0.83 | CACNA1F (0.41) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4235990 | 0.83 | HTR2C (0.44) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4232864 | 0.82 | HTR2C (0.45) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4231443 | 0.82 | CACNA1F (0.43) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4231676 | 0.78 | CACNA1F (0.45) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4227550 | 0.78 | CACNA1F (0.48) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4236313 | 0.77 | SLC6A2 (0.47) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4233227 | 0.76 | GNRHR (0.52) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL13743213 | 0.75 | GNRHR (0.54) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 | |
| SCHEMBL4235222 | 0.75 | GNRHR (0.54) | CACNA1FCHRM4ADORA3CHRM1CYP2C9 |
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-1896465-A1 | HETEROCYCLIC NON-PEPTIDE GNRH ANTAGONISTS | Takeda Cambridge Limited (GB) | 2008-03-12 | — | — | EP | disclosed |
| WO-2007000582-A1 | HETEROCYCLIC NON-PEPTIDE GNRH ANTAGONISTS | TAKEDA CAMBRIDGE LIMITED (GB) | 2007-01-04 | — | — | WO | disclosed |