Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 5/20 | 0.75 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.75 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.75 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.75 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.75 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.75 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.75 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.68 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.68 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.66 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.65 |
| ▸ | LMNA | P02545 | 2/20 | 0.65 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.65 |
| ▸ | CNR1 | P21554 | 1/20 | 0.65 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.65 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.65 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.65 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.65 |
| ▸ | GLA | P06280 | 1/20 | 0.65 |
| ▸ | CYP3A4 | P08684 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15159029 | 0.93 | ADRB2 (0.73) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL13204479 | 0.88 | ADRB2 (0.75) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL16341905 | 0.88 | PTGS1 (0.72) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL2585653 | 0.88 | PTGS1 (0.72) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL11651404 | 0.87 | ADRB2 (0.73) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL9452302 | 0.87 | ADRB2 (0.73) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL28412321 | 0.86 | PTGS1 (0.74) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| SCHEMBL220354 | 0.86 | ADRB1 (0.76) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| Metoprolol SCHEMBL1561123 | 0.86 | ADRB1 (1.00) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 | |
| (R)-Metoprolol SCHEMBL40918 | 0.86 | ADRB1 (1.00) | ADRB2ADRB1CYP2D6ADRA1ANR3C1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111110854-A | Composition comprising a histamine release-promoting substance and an inhibitory compound | 黄泳华 | 2020-05-08 | — | — | CN | claimed |
| CN-111110854-A | Composition comprising a histamine release-promoting substance and an inhibitory compound | 黄泳华 | 2020-05-08 | — | — | CN | disclosed |
| WO-2010029566-A2 | PROCESS FOR PREPARATION OF PHENOXYPROPANOL AMINES | INDOCO REMEDIES LIMITED (IN) | 2010-03-18 | — | — | WO | disclosed |
| WO-2010029566-A2 | PROCESS FOR PREPARATION OF PHENOXYPROPANOL AMINES | INDOCO REMEDIES LIMITED (IN) | 2010-03-18 | — | — | WO | disclosed |
| US-4760182-A | Process for preparing substituted phenol ethers via oxazolidine-structure intermediates | TORCAN CHEMICAL LTD. (CA) | 1988-07-26 | — | — | US | disclosed |