Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 1/20 | 0.49 |
| ▸ | CA2 | P00918 | 1/20 | 0.49 |
| ▸ | CA9 | Q16790 | 1/20 | 0.49 |
| ▸ | ADRB2 | P07550 | 2/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.48 |
| ▸ | DRD1 | P21728 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8728512 | 0.90 | ADRB2 (0.46) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL21510386 | 0.88 | ADRB2 (0.49) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL21510393 | 0.88 | KDM4E (0.52) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL8726926 | 0.87 | ADRB2 (0.47) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL3026779 | 0.84 | ADRB2 (0.49) | CA12CA1CA2CA9ADRB2 | |
| Hydrochloric Acid SCHEMBL3026243 | 0.83 | ADRB2 (0.48) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL9404939 | 0.82 | ADRB2 (0.49) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL9404905 | 0.81 | ADRB2 (0.48) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL9405021 | 0.81 | ADRB2 (0.54) | CA12CA1CA2CA9ADRB2 | |
| SCHEMBL26017634 | 0.80 | DRD1 (0.59) | CA12CA1CA2CA9ADRB2 |
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-0335545-B2 | Pharmaceutical formulations for parenteral use | UNIV FLORIDA (US) | 1998-09-23 | — | — | EP | claimed |
| EP-0327766-B1 | Redox systems for brain-targeted drug delivery | UNIV FLORIDA (US) | 1998-04-08 | — | — | EP | claimed |