Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 17/20 | 0.49 |
| ▸ | ADRB1 | P08588 | 5/20 | 0.49 |
| ▸ | DRD2 | P14416 | 3/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 2/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL7839611 | 0.93 | ADRB2 (0.46) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL7839170 | 0.89 | ADRB2 (0.46) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL7839608 | 0.85 | ADRB2 (0.37) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL9522579 | 0.85 | ADRB2 (0.54) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL9520836 | 0.84 | ADRB2 (0.55) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL9520825 | 0.84 | ADRB2 (0.55) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| Hydrochloric Acid SCHEMBL7829640 | 0.83 | ADRB2 (0.54) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| Hydrochloric Acid SCHEMBL7829647 | 0.83 | ADRB2 (0.54) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL7839090 | 0.83 | ADRB2 (0.50) | ADRB2ADRB1DRD2ABCB11PDE4A | |
| SCHEMBL7838017 | 0.82 | ADRB2 (0.55) | ADRB2ADRB1DRD2ABCB11PDE4A |
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-0558677-A1 | BIOLOGICALLY ACTIVE AMINES | Astra Pharmaceuticals Limited (GB) | 1993-09-08 | — | — | EP | claimed |
| WO-1992008708-A1 | BIOLOGICALLY ACTIVE AMINES | FISONS PLC (GB) | 1992-05-29 | — | — | WO | claimed |