Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB1 | P08588 | 19/20 | 0.43 |
| ▸ | ADRB2 | P07550 | 17/20 | 0.43 |
| ▸ | ADRB3 | P13945 | 7/20 | 0.40 |
| ▸ | DRD2 | P14416 | 2/20 | 0.40 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.40 |
| ▸ | DRD3 | P35462 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HTR1A | P08908 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | DRD4 | P21917 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | FPR3 | P25089 | 1/20 | 0.40 |
| ▸ | HTR1D | P28221 | 1/20 | 0.40 |
| ▸ | HTR1B | P28222 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
| ▸ | GPR183 | P32249 | 1/20 | 0.40 |
| ▸ | HTR7 | P34969 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL20373416 | 0.69 | ADRB2 (0.40) | ADRB1ADRB2DRD2DRD3 | |
| SCHEMBL21573556 | 0.68 | ADRB2 (0.41) | ADRB1ADRB2ADRB3DRD2ADRA1D | |
| SCHEMBL21573521 | 0.64 | KDM4E (0.37) | ADRB1ADRB2DRD2ADRA1DKDM4E | |
| SCHEMBL11692156 | 0.63 | ADRB1 (0.57) | ADRB1ADRB2DRD2ADRA1D | |
| SCHEMBL23223709 | 0.61 | ADRB2 (0.39) | ADRB1ADRB2ADRA2BADRA1A | |
| SCHEMBL29751132 | 0.61 | ADRB2 (0.70) | ADRB1ADRB2ADRB3DRD2ADRA1D | |
| SCHEMBL461364 | 0.61 | ADRB2 (0.70) | ADRB1ADRB2ADRB3DRD2ADRA1D | |
| SCHEMBL14542375 | 0.61 | ADRB2 (1.00) | ADRB1ADRB2ADRB3DRD2ADRA1D | |
| SCHEMBL14542639 | 0.60 | ADRB2 (0.81) | ADRB1ADRB2ADRB3DRD2ADRA1D | |
| SCHEMBL10477717 | 0.60 | ADRB2 (0.86) | ADRB1ADRB2ADRB3DRD2ADRA1D |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017093208-A1 | COMPOUNDS HAVING MUSCARINIC RECEPTOR ANTAGONIST AND BETA2 ADRENERGIC RECEPTOR AGONIST ACTIVITY | CHIESI FARMACEUTICI S.P.A. (IT) | 2017-06-08 | — | — | WO | disclosed |