Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Propranolol. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 known ✓ | P07550 | 5/20 | 0.65 |
| ▸ | ADRB1 known ✓ | P08588 | 5/20 | 0.65 |
| ▸ | CYP2D6 | P10635 | 5/20 | 0.65 |
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.65 |
| ▸ | SLC6A4 | P31645 | 4/20 | 0.65 |
| ▸ | HTR2A | P28223 | 4/20 | 0.65 |
| ▸ | HTR2B | P41595 | 3/20 | 0.65 |
| ▸ | NR2E1 | Q9Y466 | 3/20 | 0.65 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.65 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.65 |
| ▸ | HTR2C | P28335 | 3/20 | 0.65 |
| ▸ | HTR6 | P50406 | 3/20 | 0.65 |
| ▸ | HTR1A | P08908 | 3/20 | 0.65 |
| ▸ | LMNA | P02545 | 3/20 | 0.65 |
| ▸ | SCN1A | P35498 | 2/20 | 0.65 |
| ▸ | SLC10A1 | Q14973 | 2/20 | 0.65 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.65 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.65 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.65 |
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 | |
|---|---|---|---|---|
| Stearic Acid SCHEMBL11025256 | 0.85 | ADRB2 (0.71) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Propranolol SCHEMBL7770896 | 0.85 | ADRB2 (0.71) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Oleic Acid SCHEMBL2796167 | 0.83 | ADRB2 (0.64) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Oleic Acid SCHEMBL2796171 | 0.83 | ADRB2 (0.64) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Propranolol SCHEMBL5566676 | 0.82 | CYP2D6 (0.83) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Propranolol SCHEMBL28921627 | 0.82 | CYP2D6 (0.88) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| SCHEMBL10605795 | 0.81 | ADRB2 (0.64) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Propranolol SCHEMBL28607754 | 0.81 | CYP2D6 (0.81) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| Dexpropranolol SCHEMBL30158526 | 0.81 | CYP2D6 (0.81) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 | |
| SCHEMBL11097608 | 0.81 | ADRB2 (0.63) | ADRB2ADRB1CYP2D6SIGMAR1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101259286-B | Method for constructing liver target drug-carrying polymer micelle | UNIV ZHEJIANG | 2010-12-01 | — | — | CN | disclosed |
| CN-101259286-A | Method for constructing liver target drug-carrying polymer micelle | UNIV ZHEJIANG (CN) | 2008-09-10 | — | — | CN | disclosed |