Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA1 | P30542 | 12/20 | 0.76 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.51 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.42 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | FABP3 | P05413 | 1/20 | 0.37 |
| ▸ | FABP4 | P15090 | 1/20 | 0.37 |
| ▸ | FABP5 | Q01469 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | FTO | Q9C0B1 | 1/20 | 0.35 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.34 |
| ▸ | CLCN2 | P51788 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL27826568 | 0.91 | ADORA1 (0.65) | ADORA1ADORA2BADORA3ADORA2ATGFBR1 | |
| SCHEMBL3306156 | 0.86 | ADORA1 (1.00) | ADORA1ADORA2BADORA3ADORA2ATGFBR1 | |
| SCHEMBL3304067 | 0.85 | ADORA1 (0.77) | ADORA1ADORA2BADORA3ADORA2ATGFBR1 | |
| SCHEMBL1817011 | 0.78 | ADORA1 (0.83) | ADORA1ADORA2BADORA3ADORA2AKDM4E | |
| SCHEMBL1817013 | 0.76 | ADORA1 (0.81) | ADORA1ADORA2BADORA3ADORA2ATGFBR1 | |
| SCHEMBL28790507 | 0.76 | ADORA1 (0.42) | ADORA1TGFBR1ALDH1A1GAAMAPT | |
| SCHEMBL1816888 | 0.76 | ADORA1 (0.67) | ADORA1ADORA2BADORA3ADORA2ATGFBR1 | |
| SCHEMBL1816776 | 0.72 | ADORA1 (0.68) | ADORA1ADORA2BADORA3ADORA2ATGFBR1 | |
| SCHEMBL3305031 | 0.70 | ADORA1 (1.00) | ADORA1ADORA2BADORA3ADORA2A | |
| SCHEMBL27637060 | 0.69 | GRM5 (0.42) | ADORA1KDM4EPOLBGAAMAPT |
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-102197031-A | Substituted 5-aminopyrazoles and use thereof | BAYER SCHERING PHARMA AG | 2011-09-21 | — | — | CN | disclosed |