Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.43 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11166442 | 0.85 | POLB (0.47) | POLBALDH1A1TSHRHTR1AADRA1D | |
| SCHEMBL11078576 | 0.84 | POLB (0.46) | POLBALDH1A1TSHRHTR1AADRA1D | |
| SCHEMBL11080474 | 0.78 | HTR1A (0.43) | POLBALDH1A1HTR1AADRA1DADRA1A | |
| SCHEMBL7952028 | 0.76 | L3MBTL1 (0.46) | POLBALDH1A1TSHRKDM4EMAPT | |
| SCHEMBL7952030 | 0.76 | L3MBTL1 (0.46) | POLBALDH1A1TSHRKDM4EMAPT | |
| SCHEMBL11077053 | 0.76 | POLB (0.52) | POLBALDH1A1TSHRKDM4EMAPT | |
| SCHEMBL13916263 | 0.76 | POLB (0.49) | POLBALDH1A1TSHRHTR1AADRA1D | |
| SCHEMBL5375723 | 0.75 | ADRB2 (0.62) | POLBALDH1A1TSHRHTR1AADRA1D | |
| Methyl Alcohol SCHEMBL11168835 | 0.75 | ALDH1A1 (0.53) | POLBALDH1A1TSHRMAPTCYP1A2 | |
| SCHEMBL11548958 | 0.74 | POLB (0.57) | POLBALDH1A1TSHRKDM4EMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4438116-A | Quinoxalinyloxy-amino-propanol compounds with blood pressure lowering and β-blocking properties, their use and pharmaceutical compositions containing them | BOEHRINGER MANNHEIM GMBH (DE) | 1984-03-20 | — | — | US | disclosed |
| EP-0019918-B1 | DERIVATIVES OF AMINO-PROPANOL, PROCESSES FOR PREPARING THEM AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Roche Diagnostics GmbH (DE) | 1983-09-07 | — | — | EP | disclosed |