Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 2/20 | 0.42 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 1/20 | 0.41 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.39 |
| ▸ | HCRTR2 | O43614 | 1/20 | 0.39 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.39 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9209429 | 0.99 | ADRA1B (0.45) | ADRA1BHTR1ASLC6A4GRM5DRD4 | |
| Hydrochloric Acid SCHEMBL9214810 | 0.97 | ADRA1B (0.46) | ADRA1BHTR1ASLC6A4GRM5MEN1 | |
| Hydrochloric Acid SCHEMBL9213070 | 0.89 | ADRA1B (0.41) | ADRA1BGRM5HCRTR1HCRTR2ABCB1 | |
| Hydrochloric Acid SCHEMBL9213413 | 0.88 | ADRA1B (0.41) | ADRA1BGRM5HCRTR1HCRTR2MEN1 | |
| SCHEMBL9208286 | 0.87 | ADRA1B (0.41) | ADRA1BGRM5HCRTR1HCRTR2ABCB1 | |
| Hydrochloric Acid SCHEMBL9214235 | 0.87 | ADRA1B (0.41) | ADRA1BGRM5HCRTR1HCRTR2ABCB1 | |
| Hydrochloric Acid SCHEMBL9209655 | 0.85 | GRM5 (0.39) | ADRA1BHTR1ASLC6A4GRM5HRH3 | |
| Hydrochloric Acid SCHEMBL9207178 | 0.85 | ADRA1B (0.41) | ADRA1BGRM5HCRTR1HCRTR2MEN1 | |
| SCHEMBL9740802 | 0.84 | SIGMAR1 (0.45) | GRM5 | |
| SCHEMBL9212922 | 0.83 | HTT (0.49) | ADRA1BHTR1AGRM5DRD4DRD3 |
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 |