Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.45 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.43 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.43 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.43 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.43 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | AR | P10275 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.38 |
| ▸ | NPY2R | P49146 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7313076 | 0.86 | CYP2D6 (0.47) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL11857860 | 0.82 | ADRB1 (0.49) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL5351511 | 0.81 | CYP2D6 (0.73) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL5852432 | 0.81 | CYP2D6 (0.73) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL7215333 | 0.79 | ADRB1 (0.66) | CYP2D6ADRB1ADRB2NR3C1ADRA1A | |
| SCHEMBL15275621 | 0.79 | ADRB1 (0.66) | CYP2D6ADRB1ADRB2NR3C1ADRA1A | |
| SCHEMBL5852951 | 0.77 | ADRB1 (0.69) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL13191186 | 0.75 | AR (0.66) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL15992890 | 0.75 | AR (0.66) | MEN1KMT2ACYP2D6ADRB1ADRB2 | |
| SCHEMBL16001938 | 0.75 | S1PR1 (0.57) | MEN1KMT2ACYP2D6LMNAADRB3 |
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-7227039-B2 | RS 1-{4-[2-(allyloxy)-ethyl]phenoxy}-3-isopropylamino propan-2-ol, process for preparation thereof and process for preparation of RS betaxolol | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2007-06-05 | — | — | US | disclosed |
| US-7227039-B2 | RS 1-{4-[2-(allyloxy)-ethyl]phenoxy}-3-isopropylamino propan-2-ol, process for preparation thereof and process for preparation of RS betaxolol | COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) | 2007-06-05 | — | — | US | disclosed |