Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 4/20 | 0.73 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.73 |
| ▸ | ADRB3 | P13945 | 3/20 | 0.73 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.73 |
| ▸ | ATM | Q13315 | 1/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.66 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.66 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | CA1 | P00915 | 1/20 | 0.48 |
| ▸ | CA2 | P00918 | 1/20 | 0.48 |
| ▸ | CA9 | Q16790 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10775682 | 0.91 | ADRB2 (0.60) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL5565079 | 0.89 | ADRB2 (0.80) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| Hydrochloric Acid SCHEMBL10346456 | 0.87 | ADRB1 (0.78) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL9320164 | 0.85 | ADRB1 (0.78) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL9320148 | 0.85 | ADRB1 (0.78) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL9320119 | 0.85 | ADRB1 (0.81) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL9320098 | 0.85 | ADRB1 (0.81) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL6818065 | 0.85 | ADRB1 (1.00) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL17086818 | 0.85 | ADRB1 (1.00) | ADRB2ADRB1ADRB3CYP1A2ATM | |
| SCHEMBL10591187 | 0.85 | ADRB1 (0.77) | ADRB2ADRB1ADRB3CYP1A2ATM |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0210849-B1 | 2-HYDROXY-3-PHENOXYPROPYL AMINES | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1990-08-29 | — | — | EP | disclosed |
| US-4772631-A | Phenyl ethers | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1988-09-20 | — | — | US | disclosed |
| EP-0210849-A1 | 2-Hydroxy-3-phenoxypropyl amines | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-02-04 | — | — | EP | disclosed |