Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 11/20 | 0.61 |
| ▸ | ADRB1 | P08588 | 10/20 | 0.61 |
| ▸ | ADRB2 | P07550 | 7/20 | 0.52 |
| ▸ | CASP3 | P42574 | 1/20 | 0.52 |
| ▸ | CASP6 | P55212 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | USP2 | O75604 | 2/20 | 0.46 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.46 |
| ▸ | HTR1A | P08908 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.46 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL6553106 | 1.00 | ADRB3 (0.61) | ADRB3ADRB1ADRB2CASP3CASP6 | |
| SCHEMBL6541299 | 0.99 | ADRB3 (0.60) | ADRB3ADRB1ADRB2CASP3CASP6 | |
| SCHEMBL9007030 | 0.93 | ADRB1 (0.69) | ADRB3ADRB1ADRB2CASP3CASP6 | |
| SCHEMBL10772579 | 0.93 | ADRB1 (0.69) | ADRB3ADRB1ADRB2CASP3CASP6 | |
| SCHEMBL9006832 | 0.93 | ADRB1 (0.69) | ADRB3ADRB1ADRB2CASP3CASP6 | |
| SCHEMBL6541292 | 0.92 | ADRB3 (0.50) | ADRB3ADRB1ADRB2CYP2D6ADRA1A | |
| SCHEMBL6539647 | 0.90 | ADRB3 (0.48) | ADRB3ADRB1ADRB2CYP2D6ADRA1A | |
| SCHEMBL6539641 | 0.90 | ADRB3 (0.48) | ADRB3ADRB1ADRB2CYP2D6ADRA1A | |
| SCHEMBL11172204 | 0.86 | SLC2A1 (0.51) | ADRB3ADRB1ADRB2CYP2D6ADRA1A | |
| SCHEMBL11173351 | 0.85 | ADRB3 (0.50) | ADRB3ADRB1ADRB2CYP2D6ADRA1A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1389185-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-02-18 | — | — | EP | disclosed |
| WO-2002094770-A2 | AMINOALCOHOL DERIVATIVES | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2002-11-28 | — | — | WO | disclosed |