Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CXCR4 | P61073 | 3/20 | 0.75 |
| ▸ | APOBEC3A | P31941 | 2/20 | 0.59 |
| ▸ | APOBEC3G | Q9HC16 | 2/20 | 0.59 |
| ▸ | WDR5 | P61964 | 1/20 | 0.47 |
| ▸ | HTR1A | P08908 | 4/20 | 0.40 |
| ▸ | HTR1D | P28221 | 4/20 | 0.40 |
| ▸ | ADRA2A | P08913 | 7/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 7/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 7/20 | 0.40 |
| ▸ | PTGIR | P43119 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.37 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7541441 | 0.98 | CXCR4 (0.72) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| SCHEMBL8431121 | 0.89 | CXCR4 (0.59) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| SCHEMBL12966337 | 0.88 | — | — | |
| SCHEMBL5677296 | 0.88 | CXCR4 (0.79) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| Hydrochloric Acid SCHEMBL7478765 | 0.87 | CXCR4 (0.58) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| Bromide SCHEMBL8624628 | 0.86 | CXCR4 (0.76) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| SCHEMBL8585904 | 0.84 | CXCR4 (0.62) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| SCHEMBL17887695 | 0.82 | CXCR4 (0.61) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| SCHEMBL6440029 | 0.82 | CXCR4 (0.66) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A | |
| SCHEMBL2492454 | 0.81 | CXCR4 (0.75) | CXCR4APOBEC3AAPOBEC3GWDR5HTR1A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1216866-C | bicyclic vitronectin receptor antagonist compounds, process for their preparation and pharmaceutical compositions containing them | SERVIER LAB (FR) | 2005-08-31 | — | — | CN | disclosed |
| US-6846833-B2 | Vitronectin receptor antagonist bicyclic compounds, preparation method and compositions containing same | LES LABORATORIES SERVIER (FR) | 2005-01-25 | — | — | US | disclosed |
| EP-1268429-B1 | VITRONECTIN RECEPTOR ANTAGONIST BICYCLIC COMPOUNDS, PREPARATION METHOD AND COMPOSITIONS CONTAINING SAME | SERVIER LAB (FR) | 2004-08-18 | — | — | EP | disclosed |
| CN-1411444-A | Vitronectin receptor antagonist bicyclic compounds, preparation method and compositions containing same | SEUWIEL LAB (FR) | 2003-04-16 | — | — | CN | disclosed |