Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | HTR1A | P08908 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.48 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.48 |
| ▸ | MAOA | P21397 | 1/20 | 0.48 |
| ▸ | HTR2B | P41595 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | RAB9A | P51151 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.43 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.43 |
| ▸ | IMPDH1 | P20839 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL2154632 | 0.86 | GAA (0.50) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL103547 | 0.78 | GAA (0.46) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL11568266 | 0.78 | GAA (0.46) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL3813926 | 0.77 | HTR1A (0.52) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL1070157 | 0.76 | POLB (0.45) | GAAPOLBHTR1AADRA2AADRA2B | |
| Boric Acid SCHEMBL27921249 | 0.75 | HTR1A (0.42) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL11244858 | 0.75 | POLB (0.41) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL973234 | 0.74 | ALDH1A1 (0.54) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL11748737 | 0.74 | ALDH1A1 (0.54) | GAAPOLBHTR1AADRA2AADRA2B | |
| SCHEMBL29182356 | 0.74 | GAA (0.43) | GAAPOLBHTR1AADRA2AADRA2B |
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 |
|---|---|---|---|---|---|---|---|
| CN-108863850-A | Biaryl base class compound and its preparation method and application | 复旦大学 | 2018-11-23 | — | — | CN | disclosed |