Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 9/20 | 0.51 |
| ▸ | ADRB1 | P08588 | 7/20 | 0.51 |
| ▸ | ADRB3 | P13945 | 6/20 | 0.51 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.51 |
| ▸ | HTR1A | P08908 | 7/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.50 |
| ▸ | LMNA | P02545 | 4/20 | 0.50 |
| ▸ | HTR2C | P28335 | 4/20 | 0.50 |
| ▸ | DRD3 | P35462 | 4/20 | 0.50 |
| ▸ | TSHR | P16473 | 3/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.50 |
| ▸ | TP53 | P04637 | 2/20 | 0.50 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.50 |
| ▸ | HTR1B | P28222 | 2/20 | 0.50 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11267040 | 0.82 | DRD2 (0.59) | ADRB2ADRB1ADRB3CYP2D6HTR1A | |
| SCHEMBL11155478 | 0.76 | NR2E1 (0.58) | ADRB2ADRB1ADRB3CYP2D6HTR1A | |
| SCHEMBL11270229 | 0.76 | ADRB2 (0.43) | ADRB2ADRB1ADRB3CYP2D6HTR1A | |
| SCHEMBL11270462 | 0.76 | ADRB2 (0.48) | ADRB2ADRB1ADRB3CYP2D6HTR1A | |
| Hydrochloric Acid SCHEMBL10605116 | 0.75 | ADRB2 (0.54) | ADRB2ADRB1ADRB3CYP2D6HTR1A | |
| SCHEMBL11146826 | 0.75 | DRD2 (0.55) | ADRB2ADRB1ADRB3CYP2D6CYP1A2 | |
| SCHEMBL11266544 | 0.74 | ADRB2 (0.67) | ADRB2ADRB1ADRB3HTR1ALMNA | |
| SCHEMBL17738298 | 0.74 | DRD4 (0.51) | ADRB2ADRB1ADRB3CYP2D6HTR1A | |
| SCHEMBL10934121 | 0.74 | MEN1 (0.48) | ADRB2ADRB1ADRB3CYP2D6CYP1A2 | |
| SCHEMBL11226058 | 0.73 | SLC6A2 (0.71) | ADRB2ADRB1ADRB3CYP2D6HTR1A |
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-4346093-A | CARDIOVASCULAR DISORDERS | BOEHRINGER MANNHEIM GMBH (DE) | 1982-08-24 | — | — | US | disclosed |