Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR5 | P51681 | 1/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 13/20 | 0.42 |
| ▸ | EPAS1 | Q99814 | 2/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 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 | |
|---|---|---|---|---|
| SCHEMBL5494676 | 1.00 | CCR5 (0.46) | CCR5PTGS2EPAS1EPHX2ESR2 | |
| SCHEMBL4915625 | 0.91 | EPHX2 (0.43) | CCR5PTGS2EPHX2ESR2 | |
| SCHEMBL4915630 | 0.91 | EPHX2 (0.43) | CCR5PTGS2EPHX2ESR2 | |
| SCHEMBL27643617 | 0.82 | AKR1C3 (0.44) | CCR5PTGS2EPHX2 | |
| SCHEMBL5459229 | 0.82 | AKR1C3 (0.44) | CCR5PTGS2EPHX2 | |
| SCHEMBL20902116 | 0.79 | MDM2 (0.39) | — | |
| SCHEMBL4977528 | 0.77 | PTGS2 (0.44) | PTGS2ESR2 | |
| SCHEMBL4975056 | 0.77 | PTGS2 (0.44) | PTGS2ESR2 | |
| SCHEMBL4904275 | 0.77 | EPHX2 (0.52) | CCR5PTGS2EPHX2ESR2 | |
| SCHEMBL4904265 | 0.77 | EPHX2 (0.52) | CCR5PTGS2EPHX2ESR2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7294636-B2 | Chemical compounds | ASTRAZENECA AB (SE) | 2007-11-13 | — | — | US | disclosed |
| CN-1784393-A | Chemical compounds | ASTRAZENECA AB (SE) | 2006-06-07 | — | — | CN | disclosed |