Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AHR | P35869 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | TAF1 | P21675 | 1/20 | 0.35 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.35 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.35 |
| ▸ | CECR2 | Q9BXF3 | 1/20 | 0.35 |
| ▸ | BRD9 | Q9H8M2 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.32 |
| ▸ | PGR | P06401 | 1/20 | 0.32 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.32 |
| ▸ | AR | P10275 | 1/20 | 0.32 |
| ▸ | BACE1 | P56817 | 1/20 | 0.31 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.30 |
| ▸ | CCND1 | P24385 | 1/20 | 0.30 |
| ▸ | NOS1 | P29475 | 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 | |
|---|---|---|---|---|
| SCHEMBL445281 | 0.72 | AHR (0.56) | AHRCA12CA9KEAP1PDPK1 | |
| SCHEMBL30215965 | 0.71 | AHR (0.35) | AHRKEAP1PDPK1BACE1 | |
| SCHEMBL30215968 | 0.71 | AHR (0.34) | AHRKEAP1PDPK1BACE1 | |
| SCHEMBL16720007 | 0.70 | AHR (0.36) | AHRBRD4TAF1BRPF1CREBBP | |
| SCHEMBL16719842 | 0.70 | AHR (0.48) | AHRBRD4TAF1BRPF1CREBBP | |
| SCHEMBL15741285 | 0.68 | BIRC5 (0.38) | PDPK1 | |
| SCHEMBL16523549 | 0.68 | — | — | |
| Cyanide SCHEMBL31107459 | 0.68 | AHR (0.50) | AHRCA12CA9KEAP1PDPK1 | |
| SCHEMBL30721404 | 0.67 | CYP2E1 (0.41) | AHRBRD4TAF1BRPF1CREBBP | |
| SCHEMBL15796869 | 0.65 | PARP1 (0.52) | AHRCA12CA9KEAP1PDPK1 |
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-2023027203-A1 | LUMINESCENT MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE, ORGANIC ELECTROLUMINESCENT DEVICE USING SAME, AND MATERIAL FOR ORGANIC ELECTROLUMINESCENT DEVICE | 최돈수 | 2023-03-02 | — | — | WO | disclosed |