Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA1A | P35348 | 2/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.33 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 2/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | PRKCI | P41743 | 1/20 | 0.31 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2028893 | 0.85 | ABL1 (0.40) | ADRA1AKMT2AL3MBTL1POLBABL1 | |
| SCHEMBL24425268 | 0.81 | UBE2M (0.33) | ADRA1AKMT2AL3MBTL1ADRA1BPOLB | |
| SCHEMBL12327546 | 0.80 | NR3C2 (0.36) | ADRA1ANR3C2KMT2AL3MBTL1SLC9A1 | |
| SCHEMBL20743311 | 0.79 | KMT2A (0.33) | KMT2AL3MBTL1PRKCI | |
| SCHEMBL12844634 | 0.79 | NR3C2 (0.35) | ADRA1ANR3C2KMT2AL3MBTL1SLC9A1 | |
| SCHEMBL26693414 | 0.78 | MAPT (0.43) | KMT2AL3MBTL1EPHX2ALDH1A1 | |
| SCHEMBL16815383 | 0.77 | NR3C2 (0.38) | ADRA1ANR3C2KMT2AL3MBTL1EPHX2 | |
| SCHEMBL9455595 | 0.77 | NR3C2 (0.35) | ADRA1ANR3C2KMT2ASLC9A1POLB | |
| SCHEMBL4327171 | 0.77 | NR3C2 (0.38) | ADRA1ANR3C2KMT2AL3MBTL1SLC9A1 | |
| SCHEMBL10061627 | 0.76 | — | — |
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-3038466-B1 | 2,2-DIFLUORODIOXOLO A2A RECEPTOR ANTAGONISTS | MERCK SHARP & DOHME (US) | 2018-05-23 | — | — | EP | disclosed |