Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE4D | Q08499 | 11/20 | 0.49 |
| ▸ | HTR1A | P08908 | 4/20 | 0.47 |
| ▸ | PDE4A | P27815 | 3/20 | 0.47 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.47 |
| ▸ | PDE4C | Q08493 | 3/20 | 0.47 |
| ▸ | DRD2 | P14416 | 1/20 | 0.44 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 1/20 | 0.44 |
| ▸ | HTR1D | P28221 | 1/20 | 0.43 |
| ▸ | HTR1B | P28222 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL9740012 | 0.98 | PDE4D (0.48) | PDE4DHTR1APDE4APDE4BPDE4C | |
| SCHEMBL9215979 | 0.95 | PDE4D (0.48) | PDE4DHTR1APDE4APDE4BPDE4C | |
| Hydrochloric Acid SCHEMBL9741187 | 0.95 | PDE4D (0.48) | PDE4DHTR1APDE4APDE4BPDE4C | |
| Water SCHEMBL9740391 | 0.94 | PDE4D (0.47) | PDE4DHTR1APDE4APDE4BPDE4C | |
| SCHEMBL9216130 | 0.91 | HTR1A (0.47) | HTR1ADRD2HTR2ASLC6A4HTR7 | |
| Hydrochloric Acid SCHEMBL9742003 | 0.90 | PDE4D (0.46) | PDE4DHTR1APDE4APDE4BPDE4C | |
| Water SCHEMBL9739470 | 0.87 | HTR1A (0.45) | HTR1ADRD2HTR2ASLC6A4HTR7 | |
| SCHEMBL9215673 | 0.84 | HTR1A (0.45) | PDE4DHTR1APDE4APDE4BPDE4C | |
| SCHEMBL9207818 | 0.83 | HTR1A (0.43) | HTR1ADRD2HTR2ASLC6A4HTR7 | |
| Hydrochloric Acid SCHEMBL9207604 | 0.82 | HTR1A (0.52) | PDE4DHTR1ADRD2HTR2ASLC6A4 |
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-0292840-B1 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | THOMAE GMBH DR K (DE) | 1995-08-09 | — | — | EP | disclosed |
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |
| EP-0292840-A2 | Cyclic amine derivatives, medicaments containing these compounds and procedure for their preparation | Dr. Karl Thomae GmbH (DE) | 1988-11-30 | — | — | EP | disclosed |