Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.47 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.47 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | PTGIR | P43119 | 2/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.37 |
| ▸ | SLC18A3 | Q16572 | 4/20 | 0.37 |
| ▸ | ABCB1 | P08183 | 10/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13077495 | 0.76 | ADRB2 (0.52) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL13077531 | 0.76 | ADRB2 (0.43) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL13077540 | 0.72 | ADRB2 (0.58) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL13077546 | 0.70 | ADRB2 (0.53) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL13148927 | 0.67 | TSHR (0.76) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL13077494 | 0.67 | ADRB2 (0.44) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL14069773 | 0.67 | ADRB2 (0.67) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL11514678 | 0.66 | ADRB1 (0.73) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL11669644 | 0.66 | ADRB1 (0.73) | TSHRADRB2ADRB1ADRA1ARECQL | |
| SCHEMBL11669647 | 0.66 | ADRB1 (0.73) | TSHRADRB2ADRB1ADRA1ARECQL |
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 |