Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 1/20 | 0.45 |
| ▸ | DRD4 | P21917 | 1/20 | 0.45 |
| ▸ | DRD3 | P35462 | 1/20 | 0.45 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HRH3 | Q9Y5N1 | 8/20 | 0.42 |
| ▸ | HTR2A | P28223 | 2/20 | 0.42 |
| ▸ | HTR7 | P34969 | 2/20 | 0.42 |
| ▸ | HTR6 | P50406 | 2/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
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 SCHEMBL9213450 | 0.82 | ADRA1B (0.43) | HTR1ADRD4DRD3ADRA1BTDP1 | |
| Hydrochloric Acid SCHEMBL9208281 | 0.81 | HTR1A (0.43) | HTR1ADRD4DRD3ADRA1BABCB1 | |
| Hydrochloric Acid SCHEMBL9215824 | 0.81 | MEN1 (0.42) | HTR1ADRD4DRD3ADRA1BABCB1 | |
| SCHEMBL9206041 | 0.79 | ADRA1B (0.42) | HTR1ADRD4DRD3ADRA1BABCB1 | |
| Hydrochloric Acid SCHEMBL9212120 | 0.79 | DRD4 (0.42) | HTR1ADRD4DRD3ADRA1BHRH3 | |
| SCHEMBL9217265 | 0.78 | DRD4 (0.43) | HTR1ADRD4DRD3ADRA1BHRH3 | |
| Hydrochloric Acid SCHEMBL9208323 | 0.77 | DRD2 (0.43) | HTR1ADRD4DRD3ADRA1BABCB1 | |
| Hydrochloric Acid SCHEMBL9206844 | 0.76 | CYP3A4 (0.47) | HTR1ADRD4DRD3ADRA1BTDP1 | |
| Hydrochloric Acid SCHEMBL9739072 | 0.76 | FAAH (0.43) | HTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL9207084 | 0.74 | ADRA1B (0.39) | HTR1ADRD4DRD3ADRA1BABCB1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5175157-A | Cardiovascular disorders | BOEHRINGER INGELHEIM GMBH (DE) | 1992-12-29 | — | — | US | disclosed |