Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 2/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.39 |
| ▸ | ADRB3 | P13945 | 2/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.39 |
| ▸ | UTS2R | Q9UKP6 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CDC25B | P30305 | 2/20 | 0.37 |
| ▸ | CNR1 | P21554 | 4/20 | 0.36 |
| ▸ | CNR2 | P34972 | 4/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | CACNA1B | Q00975 | 2/20 | 0.33 |
| ▸ | APBA1 | Q02410 | 2/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17307936 | 0.92 | CNR1 (0.44) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL19223417 | 0.90 | UTS2R (0.40) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL822783 | 0.88 | ADRB2 (0.47) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL19223359 | 0.88 | ADRB2 (0.38) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL172229 | 0.83 | ADRB2 (0.45) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL17320114 | 0.81 | ALDH1A1 (0.39) | ADRB2ADRB1ADRB3HRH3ALDH1A1 | |
| SCHEMBL9360245 | 0.79 | CNR1 (0.54) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL12018026 | 0.79 | ALDH1A1 (0.51) | ADRB2ADRB1ADRB3ALDH1A1HPGD | |
| SCHEMBL17307938 | 0.78 | CNR1 (0.44) | ADRB2ADRB1ADRB3HRH3UTS2R | |
| SCHEMBL17320104 | 0.75 | UTS2R (0.39) | ADRB2ADRB1ADRB3HRH3UTS2R |
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 |
|---|---|---|---|---|---|---|---|
| EP-2952516-A1 | POLYSILOXANE COMPOUND AND DENTAL MATERIALS THAT CAN BE PRODUCED FROM SAME | VOCO GmbH (DE) | 2015-12-09 | — | — | EP | disclosed |