Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 2/20 | 0.46 |
| ▸ | CCR5 | P51681 | 2/20 | 0.46 |
| ▸ | CCR8 | P51685 | 2/20 | 0.46 |
| ▸ | PSMD14 | O00487 | 1/20 | 0.37 |
| ▸ | COPS5 | Q92905 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | KDM5A | P29375 | 1/20 | 0.36 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.36 |
| ▸ | NOS3 | P29474 | 3/20 | 0.35 |
| ▸ | NOS2 | P35228 | 3/20 | 0.35 |
| ▸ | AR | P10275 | 4/20 | 0.33 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.32 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.31 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.31 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL1984578 | 0.82 | CCR1 (0.42) | CCR1CCR5CCR8PSMD14COPS5 | |
| SCHEMBL13132297 | 0.77 | TRIM24 (0.51) | CCR1CCR5CCR8PSMD14COPS5 | |
| SCHEMBL18509077 | 0.77 | CCR1 (0.38) | CCR1CCR5CCR8PSMD14COPS5 | |
| SCHEMBL28967640 | 0.75 | MEN1 (0.45) | CCR1CCR5CCR8L3MBTL1NPC1 | |
| SCHEMBL30166973 | 0.75 | MEN1 (0.45) | CCR1CCR5CCR8L3MBTL1NPC1 | |
| SCHEMBL12238753 | 0.74 | KDM5A (0.44) | CCR1CCR5CCR8KDM5AKDM4C | |
| SCHEMBL5329762 | 0.73 | CCR1 (0.31) | CCR1CCR5CCR8 | |
| SCHEMBL28967616 | 0.71 | KDM5A (0.36) | CCR1CCR5CCR8KDM5AKDM4C | |
| SCHEMBL5433974 | 0.70 | — | — | |
| SCHEMBL12203219 | 0.70 | CCR1 (0.65) | CCR1CCR5CCR8PSMD14COPS5 |
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-1363705-B1 | COMPOSITION AND ANTIVIRAL ACTIVITY OF SUBSTITUTED AZAINDOLEOXOACETIC PIPERAZINE DERIVATIVES | BRISTOL MYERS SQUIBB CO (US) | 2012-06-13 | — | — | EP | disclosed |