Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 1/20 | 0.44 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.44 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.43 |
| ▸ | GPR119 | Q8TDV5 | 1/20 | 0.42 |
| ▸ | UCHL1 | P09936 | 1/20 | 0.42 |
| ▸ | GRM5 | P41594 | 3/20 | 0.41 |
| ▸ | GRM1 | Q13255 | 2/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.41 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | C5AR1 | P21730 | 1/20 | 0.39 |
| ▸ | FNTA | P49354 | 1/20 | 0.39 |
| ▸ | FNTB | P49356 | 1/20 | 0.39 |
| ▸ | NAMPT | P43490 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL951930 | 0.91 | ESR2 (0.44) | ESR2NR1H2MAPK1PDK4GPR119 | |
| SCHEMBL1751873 | 0.85 | ESR2 (0.48) | ESR2NR1H2MAPK1PDK4GPR119 | |
| SCHEMBL951733 | 0.82 | NR1H2 (0.47) | ESR2NR1H2MAPK1PDK4GPR119 | |
| SCHEMBL22418001 | 0.81 | ESR2 (0.42) | ESR2NR1H2MAPK1PDK4GPR119 | |
| SCHEMBL951850 | 0.78 | ESR2 (0.48) | ESR2NR1H2MAPK1PDK4GPR119 | |
| SCHEMBL14403276 | 0.77 | CHRM2 (0.50) | ESR2NR1H2MAPK1GPR119UCHL1 | |
| SCHEMBL31449954 | 0.76 | ADORA1 (0.45) | ESR2NR1H2MAPK1PDK4ADORA1 | |
| SCHEMBL31088389 | 0.76 | GPR119 (0.41) | ESR2MAPK1PDK4GPR119NAMPT | |
| SCHEMBL3799422 | 0.75 | ESR2 (0.44) | ESR2NR1H2GRM5GRM1ADORA1 | |
| SCHEMBL23062555 | 0.74 | ESR2 (0.46) | ESR2NR1H2MAPK1GPR119GRM5 |
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-6277871-B1 | ANTICANCER AGENTS | ABBOTT LABORATORIES | 2001-08-21 | — | — | US | disclosed |