Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 4/20 | 0.52 |
| ▸ | ADRB1 | P08588 | 4/20 | 0.52 |
| ▸ | LMNA | P02545 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 2/20 | 0.52 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.52 |
| ▸ | RECQL | P46063 | 1/20 | 0.52 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.36 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.36 |
| ▸ | PTGIR | P43119 | 1/20 | 0.36 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.36 |
| ▸ | SLC18A3 | Q16572 | 5/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 4/20 | 0.31 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13077494 | 0.88 | ADRB2 (0.44) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13077546 | 0.80 | ADRB2 (0.53) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13077516 | 0.79 | HTR1A (0.50) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13077531 | 0.77 | ADRB2 (0.43) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13077521 | 0.77 | ADRB2 (0.58) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13040085 | 0.77 | ADRB2 (0.43) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13077484 | 0.76 | TSHR (0.47) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL14571126 | 0.72 | ADRB2 (0.51) | ADRB2ADRB1LMNATSHRADRA1A | |
| SCHEMBL13077514 | 0.71 | ADRB2 (0.46) | ADRB2ADRB1LMNATSHRADRA1A | |
| R-Nadolol SCHEMBL17261862 | 0.69 | ADRB2 (1.00) | ADRB2ADRB1LMNATSHRADRA1A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7825263-B2 | Nitrooxyderivatives of carvedilol and other beta blockers as antihypertensive | NICOX S.A. (FR) | 2010-11-02 | — | — | US | disclosed |