Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 2/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.37 |
| ▸ | ATM | Q13315 | 2/20 | 0.35 |
| ▸ | PARP1 | P09874 | 2/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 2/20 | 0.34 |
| ▸ | PARP3 | Q9Y6F1 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | SYK | P43405 | 3/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.33 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 2/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.32 |
| ▸ | JAK2 | O60674 | 1/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | TYK2 | P29597 | 1/20 | 0.32 |
| ▸ | JAK3 | P52333 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL345169 | 0.89 | ADORA2A (0.37) | ADORA2AADORA1ATMPARP1PARP2 | |
| Hydrochloric Acid SCHEMBL31096988 | 0.88 | ADORA2A (0.36) | ADORA2AADORA1ATMPARP1PARP2 | |
| SCHEMBL19321638 | 0.87 | ADORA2A (0.38) | ADORA2AADORA1ATMPARP1PARP2 | |
| SCHEMBL1085956 | 0.86 | ADORA2A (0.36) | ADORA2AADORA1ATMPARP1PARP2 | |
| Thiourea SCHEMBL28847920 | 0.85 | GAA (0.36) | ADORA2AADORA1ATMPARP1PARP2 | |
| SCHEMBL9266924 | 0.82 | LMNA (0.35) | ATMRAB9AGAAPOLBIRAK4 | |
| Acetic Acid Methyl Ester SCHEMBL18335125 | 0.81 | ATM (0.36) | ADORA2AADORA1ATMPARP1PARP2 | |
| SCHEMBL30691883 | 0.78 | IRAK4 (0.35) | ADORA2AADORA1GAAIRAK4 | |
| SCHEMBL15971596 | 0.76 | ADORA2A (0.40) | ADORA2AADORA1PARP1GAAPOLB | |
| SCHEMBL29002489 | 0.75 | ADORA2A (0.42) | ADORA2AADORA1ATMPARP1PARP2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3075727-B1 | PYRAZOLE AMIDE COMPOUND AND USE THEREOF | SHENYANG SINOCHEM AGROCHEMICALS R & D CO LTD (CN) | 2020-04-01 | — | — | EP | disclosed |
| JP-2001342179-A | 3-(1-FLUOROETHYL)-1-METHYLPYRAZOLE-4-CARBOXYLIC ACID AMIDE DERIVATIVE AND PEST-CONTROLLING AGENT FOR AGRICULTURE AND HORTICULTURE | UBE IND LTD | 2001-12-11 | — | — | JP | disclosed |
| JP-2001342179-A | 3-(1-FLUOROETHYL)-1-METHYLPYRAZOLE-4-CARBOXYLIC ACID AMIDE DERIVATIVE AND PEST-CONTROLLING AGENT FOR AGRICULTURE AND HORTICULTURE | UBE IND LTD | 2001-12-11 | — | — | JP | disclosed |