Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB11 | O95342 | 2/20 | 0.77 |
| ▸ | ADRB2 | P07550 | 18/20 | 0.74 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.74 |
| ▸ | DRD2 | P14416 | 2/20 | 0.74 |
| ▸ | PDE4A | P27815 | 1/20 | 0.74 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7839511 | 0.99 | ABCB11 (0.76) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| SCHEMBL7829477 | 0.91 | ADRB2 (0.81) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| Hydrochloric Acid SCHEMBL7842790 | 0.90 | ADRB2 (0.80) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| SCHEMBL8528403 | 0.87 | ABCB11 (0.93) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| SCHEMBL7828804 | 0.87 | ADRB2 (0.62) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| Hydrochloric Acid SCHEMBL8527365 | 0.86 | ABCB11 (0.92) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| Sibenadet SCHEMBL30438496 | 0.85 | ADRB2 (1.00) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| Sibenadet SCHEMBL48983 | 0.85 | ADRB2 (1.00) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| Sibenadet SCHEMBL249498 | 0.84 | ADRB2 (0.98) | ABCB11ADRB2ADRB1DRD2PDE4A | |
| SCHEMBL8879323 | 0.84 | ADRB2 (0.61) | ABCB11ADRB2ADRB1DRD2PDE4A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0558677-B1 | BIOLOGICALLY ACTIVE AMINES | ASTRAZENECA AB (SE) | 2001-08-16 | — | — | EP | claimed |
| US-5648370-A | 7-(2-aminoethyl) benzothiazolones | ASTRA PHARMACEUTICALS LIMITED (GB) | 1997-07-15 | — | — | US | claimed |
| 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 |