Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | NOD2 | Q9HC29 | 1/20 | 0.37 |
| ▸ | NOD1 | Q9Y239 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | STS | P08842 | 1/20 | 0.34 |
| ▸ | CNR1 | P21554 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | PIK3R2 | O00459 | 3/20 | 0.34 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.34 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.34 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.34 |
| ▸ | TLR2 | O60603 | 1/20 | 0.33 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.33 |
| ▸ | RAF1 | P04049 | 1/20 | 0.33 |
| ▸ | BRAF | P15056 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL17338369 | 0.96 | KEAP1 (0.42) | KEAP1NFE2L2BACE1NOD2NOD1 | |
| SCHEMBL17338203 | 0.91 | BACE1 (0.38) | KEAP1NFE2L2BACE1PIK3R2PIK3CD | |
| SCHEMBL17338320 | 0.89 | KEAP1 (0.33) | KEAP1NFE2L2BACE1NOD2NOD1 | |
| SCHEMBL17338356 | 0.88 | BACE1 (0.38) | KEAP1NFE2L2BACE1KMT2ACNR1 | |
| SCHEMBL17338180 | 0.88 | KEAP1 (0.43) | KEAP1NFE2L2BACE1NOD2NOD1 | |
| SCHEMBL17338255 | 0.86 | KEAP1 (0.38) | KEAP1NFE2L2BACE1NOD2NOD1 | |
| SCHEMBL17338154 | 0.85 | KEAP1 (0.40) | KEAP1NFE2L2BACE1NOD2NOD1 | |
| SCHEMBL17338201 | 0.85 | BACE1 (0.39) | KEAP1NFE2L2BACE1NOD2NOD1 | |
| SCHEMBL17330659 | 0.84 | PIK3R2 (0.46) | BACE1PIK3R2PIK3CD | |
| SCHEMBL17330660 | 0.84 | PIK3R2 (0.46) | BACE1PIK3R2PIK3CD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3154958-A1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | Gilead Sciences, Inc. (US) | 2017-04-19 | — | — | EP | disclosed |
| WO-2015191752-A1 | PHOSPHATIDYLINOSITOL 3-KINASE INHIBITORS | GILEAD SCIENCES, INC. (US) | 2015-12-17 | — | — | WO | disclosed |