Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.36 |
| ▸ | IRAK4 | Q9NWZ3 | 2/20 | 0.34 |
| ▸ | IRAK1 | P51617 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL18943857 | 1.00 | BRD4 (0.36) | BRD4CREBBPIRAK4IRAK1ALDH1A1 | |
| SCHEMBL21241478 | 1.00 | BRD4 (0.36) | BRD4CREBBPIRAK4IRAK1ALDH1A1 | |
| SCHEMBL22701749 | 0.84 | IRAK4 (0.33) | IRAK4IRAK1ALDH1A1L3MBTL1 | |
| SCHEMBL26838204 | 0.80 | IRAK4 (0.43) | IRAK4IRAK1 | |
| SCHEMBL16841452 | 0.80 | IRAK4 (0.43) | IRAK4IRAK1 | |
| SCHEMBL23724864 | 0.79 | IRAK4 (0.34) | IRAK4IRAK1 | |
| SCHEMBL209722 | 0.79 | CREBBP (0.36) | CREBBPIRAK4IRAK1 | |
| SCHEMBL15549632 | 0.79 | CREBBP (0.36) | CREBBPIRAK4IRAK1 | |
| SCHEMBL209721 | 0.79 | CREBBP (0.36) | CREBBPIRAK4IRAK1 | |
| SCHEMBL21241715 | 0.79 | IRAK4 (0.35) | IRAK4IRAK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019149522-A1 | QUINOLINE COMPOUNDS AS IRAK INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2019-08-08 | — | — | WO | disclosed |