Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 3/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 3/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | CCNC | P24863 | 1/20 | 0.31 |
| ▸ | CDK8 | P49336 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL12307483 | 0.89 | KEAP1 (0.33) | KEAP1NFE2L2CCNCCDK8HDAC1 | |
| SCHEMBL12307482 | 0.88 | NLRP3 (0.41) | TSHRCCNCCDK8POLB | |
| SCHEMBL12307395 | 0.82 | GCK (0.35) | HDAC1HDAC6 | |
| SCHEMBL12307554 | 0.80 | PIK3CG (0.36) | HDAC1HDAC6 | |
| SCHEMBL171623 | 0.73 | PTGER1 (0.43) | TSHRPOLB | |
| SCHEMBL12307448 | 0.72 | GRM5 (0.32) | — | |
| SCHEMBL798568 | 0.71 | TP53 (0.41) | — | |
| SCHEMBL22074956 | 0.70 | ESR2 (0.36) | POLBHDAC1HDAC6 | |
| SCHEMBL172068 | 0.70 | NR1H2 (0.41) | POLBHDAC1HDAC6 | |
| SCHEMBL169996 | 0.69 | ALDH1A1 (0.42) | HDAC1HDAC6 |
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-2327704-A1 | RING-FUSED AZOLE DERIVATIVE HAVING PI3K-INHIBITING ACTIVITY | Shionogi&Co., Ltd. (JP) | 2011-06-01 | — | — | EP | disclosed |