Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 3/20 | 0.55 |
| ▸ | HTR7 | P34969 | 3/20 | 0.55 |
| ▸ | DRD2 | P14416 | 2/20 | 0.55 |
| ▸ | HTR1D | P28221 | 2/20 | 0.55 |
| ▸ | DRD3 | P35462 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | HTR1B | P28222 | 1/20 | 0.55 |
| ▸ | HTR2A | P28223 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.55 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | HTR5A | P47898 | 1/20 | 0.55 |
| ▸ | BLM | P54132 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9759040 | 0.90 | HTR1A (0.57) | HTR1AHTR7DRD2HTR1DDRD3 | |
| SCHEMBL9759427 | 0.90 | HTR1A (0.50) | HTR1AHTR7DRD2HTR1DDRD3 | |
| Hydrochloric Acid SCHEMBL9760000 | 0.89 | HTR1A (0.56) | HTR1AHTR7DRD2HTR1DDRD3 | |
| SCHEMBL9758950 | 0.87 | HTR1A (0.58) | HTR1AHTR7DRD2HTR1DDRD3 | |
| SCHEMBL9758050 | 0.86 | HTR1A (0.57) | HTR1AHTR7DRD2HTR1DDRD3 | |
| SCHEMBL9759895 | 0.84 | HTR1D (0.67) | HTR1ADRD2HTR1DDRD3HTR1B | |
| SCHEMBL9758475 | 0.80 | HTR1A (0.57) | HTR1AHTR7DRD2HTR1DDRD3 | |
| SCHEMBL10639628 | 0.79 | HTR1A (0.56) | HTR1AHTR7DRD2HTR1DDRD3 | |
| SCHEMBL9758412 | 0.79 | HTR1A (0.61) | HTR1AHTR7DRD2HTR1DDRD3 | |
| Hydrochloric Acid SCHEMBL9758088 | 0.78 | HTR1A (0.55) | HTR1AHTR7DRD2HTR1DDRD3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5047422-A | Treating A Disorder Of The Central Nervous System, Cardiovascular System Or Intestinal Tract | BAYER AKTIENGESELLSCHAFT (DE) | 1991-09-10 | — | — | US | disclosed |
| US-4968679-A | DISORDERS OF CENTRAL NERVOUS SYSTEM, CARDIOVASCULAR SYSTEM OR INTESTINAL TRACT | BAYER AKTIENGESELLSCHAFT (DE) | 1990-11-06 | — | — | US | disclosed |
| US-4873262-A | TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, CARDIIOVASCULAR SYSTEM OR INTESTINAL TRACT | BAYER AKTIENGESELLSCHAFT (DE) | 1989-10-10 | — | — | US | disclosed |
| EP-0272534-A2 | 8-substituted 2-aminotetralins | BAYER AG (DE) | 1988-06-29 | — | — | EP | disclosed |