Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RPS6KB2 | Q9UBS0 | 5/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.40 |
| ▸ | DHFR | P00374 | 1/20 | 0.40 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | RAB9A | P51151 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL7693614 | 0.89 | ENPP1 (0.43) | ADORA2APTGER1ENPP1MAPTGAA | |
| SCHEMBL7691803 | 0.87 | RPS6KB2 (0.51) | RPS6KB2ADORA2ADHFRALDH1A1KDM4E | |
| SCHEMBL7699647 | 0.76 | RPS6KB2 (0.73) | RPS6KB2ADORA2AALDH1A1KDM4EMAPT | |
| SCHEMBL1644280 | 0.76 | MEN1 (0.47) | RPS6KB2ADORA2ADHFRALDH1A1KDM4E | |
| SCHEMBL21066891 | 0.70 | DHFR (0.47) | RPS6KB2ADORA2ADHFRALDH1A1KDM4E | |
| SCHEMBL12715488 | 0.69 | DHFR (0.53) | RPS6KB2ADORA2ADHFRALDH1A1KDM4E | |
| SCHEMBL7692593 | 0.69 | DHFR (0.43) | ADORA2ADHFRALDH1A1KDM4EMAPT | |
| SCHEMBL769338 | 0.68 | CYP2A6 (0.50) | ALDH1A1KDM4EMAPTMEN1HPGD | |
| SCHEMBL7695816 | 0.66 | ALDH1A1 (0.43) | ADORA2AALDH1A1KDM4EMAPTMEN1 | |
| SCHEMBL21313201 | 0.65 | ADORA2A (0.49) | ADORA2ADHFRALDH1A1KDM4EMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002094796-A2 | BENZO[G]QUINOXALINE DERIVATIVES AS EFFECTIVE COMPOUNDS AGAINST INFECTIOUS DISEASES | AXXIMA PHARMACEUTICALS AG (DE) | 2002-11-28 | — | — | WO | disclosed |