Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 8/20 | 0.63 |
| ▸ | DRD2 | P14416 | 3/20 | 0.63 |
| ▸ | MAPT | P10636 | 2/20 | 0.63 |
| ▸ | TLR4 | O00206 | 2/20 | 0.63 |
| ▸ | DNM1 | Q05193 | 2/20 | 0.63 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | HTR1A | P08908 | 2/20 | 0.63 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.63 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.63 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.63 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.63 |
| ▸ | MLNR | O43193 | 1/20 | 0.63 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.63 |
| ▸ | KCNK2 | O95069 | 1/20 | 0.63 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.63 |
| ▸ | APP | P05067 | 1/20 | 0.63 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.63 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.63 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.63 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL13077008 | 0.97 | ADRB2 (0.61) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13077007 | 0.90 | ADRB2 (0.62) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13076998 | 0.88 | ADRB2 (0.61) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13040011 | 0.88 | ADRB2 (0.61) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL1326738 | 0.86 | ADRB2 (0.74) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13077009 | 0.86 | ADRB2 (0.51) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13040114 | 0.86 | ADRB2 (0.59) | ADRB2DRD2MAPTTLR4DNM1 | |
| Hydrochloric Acid SCHEMBL3725962 | 0.85 | ADRB2 (0.58) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13077071 | 0.84 | ADRB2 (0.47) | ADRB2DRD2MAPTTLR4DNM1 | |
| SCHEMBL13077070 | 0.84 | ADRB2 (0.61) | ADRB2DRD2MAPTTLR4DNM1 |
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 |