Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 6/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.39 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.39 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.39 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | HRH2 | P25021 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5508279 | 0.95 | HRH3 (0.40) | CXCR4HRH3 | |
| SCHEMBL5506778 | 0.92 | CXCR4 (0.48) | CXCR4SCN1ASCN2ASCN3AACHE | |
| SCHEMBL5502757 | 0.92 | CXCR4 (0.48) | CXCR4SCN1ASCN2ASCN3AACHE | |
| SCHEMBL5507035 | 0.90 | HRH3 (0.45) | CXCR4SCN1ASCN2ASCN3AHRH3 | |
| SCHEMBL5502177 | 0.89 | HRH3 (0.47) | CXCR4SCN1ASCN2ASCN3AACHE | |
| SCHEMBL5506019 | 0.89 | CXCR4 (0.46) | CXCR4SCN1ASCN2ASCN3AACHE | |
| SCHEMBL5508034 | 0.88 | HRH3 (0.44) | CXCR4HRH3 | |
| SCHEMBL5508661 | 0.85 | HRH3 (0.50) | CXCR4HRH3 | |
| SCHEMBL5501569 | 0.85 | CXCR4 (0.41) | CXCR4SCN1ASCN2ASCN3AACHE | |
| SCHEMBL5505526 | 0.85 | HRH3 (0.43) | CXCR4HRH3 |
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-1847530-A1 | DIAMINE DERIVATIVE | KYOWA HAKKO KOGYO CO., LTD. (JP) | 2007-10-24 | — | — | EP | disclosed |