Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 12/20 | 0.65 |
| ▸ | ADRA1B | P35368 | 9/20 | 0.65 |
| ▸ | ADRA1D | P25100 | 9/20 | 0.65 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.47 |
| ▸ | DRD4 | P21917 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL5302822 | 0.91 | ADRA1A (0.65) | ADRA1AADRA1BADRA1DHTR1ADRD3 | |
| SCHEMBL5325863 | 0.90 | DRD2 (0.59) | ADRA1AADRA1BADRA1DHTR1ADRD3 | |
| SCHEMBL5328407 | 0.88 | SLC6A4 (0.55) | ADRA1AADRA1BADRA1DHTR1ADRD3 | |
| SCHEMBL4530003 | 0.85 | ADRA1A (0.57) | ADRA1AADRA1BADRA1DHTR1A | |
| SCHEMBL5306802 | 0.85 | ADRA1A (0.49) | ADRA1AADRA1BADRA1DDRD3DRD2 | |
| Hydrochloric Acid SCHEMBL4534626 | 0.84 | ADRA1A (0.56) | ADRA1AADRA1BADRA1DHTR1A | |
| SCHEMBL5808003 | 0.83 | ADRA1A (0.53) | ADRA1AADRA1BADRA1DHTR1ADRD4 | |
| SCHEMBL4874588 | 0.83 | ADRA1A (0.56) | ADRA1AADRA1BADRA1DHTR1ADRD3 | |
| SCHEMBL5423788 | 0.83 | HTR1A (0.57) | ADRA1AADRA1BADRA1DHTR1ADRD3 | |
| Hydrochloric Acid SCHEMBL5807427 | 0.82 | ADRA1A (0.52) | ADRA1AADRA1BADRA1DHTR1ADRD4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007029156-A2 | ISOINDOLEDIONE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-03-15 | — | — | WO | claimed |
| WO-2007029156-A2 | ISOINDOLEDIONE DERIVATIVES AS ADRENERGIC RECEPTOR ANTAGONISTS | RANBAXY LABORATORIES LIMITED (IN) | 2007-03-15 | — | — | WO | disclosed |