Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 10/20 | 0.45 |
| ▸ | NMUR2 | Q9GZQ4 | 2/20 | 0.42 |
| ▸ | NMUR1 | Q9HB89 | 2/20 | 0.42 |
| ▸ | APLNR | P35414 | 1/20 | 0.42 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30275450 | 0.95 | CXCR4 (0.46) | CXCR4NMUR2NMUR1APLNRKEAP1 | |
| SCHEMBL28356821 | 0.95 | CXCR4 (0.47) | CXCR4NMUR2NMUR1APLNR | |
| SCHEMBL31655163 | 0.94 | CXCR4 (0.47) | CXCR4NMUR2NMUR1APLNRKEAP1 | |
| SCHEMBL31655138 | 0.92 | NMUR2 (0.43) | CXCR4NMUR2NMUR1KEAP1 | |
| SCHEMBL30006262 | 0.91 | NMUR2 (0.46) | CXCR4NMUR2NMUR1 | |
| SCHEMBL31655366 | 0.90 | NMUR2 (0.43) | CXCR4NMUR2NMUR1KEAP1 | |
| SCHEMBL30065432 | 0.88 | APLNR (0.49) | CXCR4APLNR | |
| SCHEMBL30767145 | 0.86 | NMUR2 (0.46) | CXCR4NMUR2NMUR1APLNR | |
| SCHEMBL30887061 | 0.86 | CXCR4 (0.41) | CXCR4NMUR2NMUR1KEAP1 | |
| SCHEMBL29579268 | 0.85 | CXCR4 (0.48) | CXCR4APLNR |
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 |
|---|---|---|---|---|---|---|---|
| CN-114010783-B | Multifunctional boron-rich nano targeting preparation based on covalent organic framework material, and preparation method and application thereof | 大连理工大学 | 2022-10-18 | — | — | CN | disclosed |
| CN-114010783-A | Multifunctional boron-rich nano targeting preparation based on covalent organic framework material, and preparation method and application thereof | 大连理工大学 | 2022-02-08 | — | — | CN | disclosed |