Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 6/20 | 0.40 |
| ▸ | NSD2 | O96028 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
| ▸ | HTR3A | P46098 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 6/20 | 0.34 |
| ▸ | F10 | P00742 | 1/20 | 0.34 |
| ▸ | CCR2 | P41597 | 1/20 | 0.34 |
| ▸ | CCR5 | P51681 | 1/20 | 0.34 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.33 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.33 |
| ▸ | JAK2 | O60674 | 1/20 | 0.33 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.33 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.33 |
| ▸ | PAK4 | O96013 | 1/20 | 0.33 |
| ▸ | ABL1 | P00519 | 1/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
| ▸ | FYN | P06241 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4416711 | 0.92 | CNR1 (0.37) | CNR1CNR2PDE5AF10CCR2 | |
| SCHEMBL4413722 | 0.92 | F10 (0.35) | CNR1CNR2F10CCR2CCR5 | |
| SCHEMBL4421724 | 0.91 | F10 (0.36) | CNR1F10CCR2CCR5KMT2A | |
| SCHEMBL4428598 | 0.91 | F10 (0.36) | CNR1CNR2F10CCR2CCR5 | |
| SCHEMBL4415059 | 0.90 | CCR2 (0.35) | CNR1CNR2F10CCR2CCR5 | |
| SCHEMBL4420896 | 0.90 | CCR2 (0.36) | CNR1NSD2CNR2F10CCR2 | |
| SCHEMBL4417993 | 0.90 | NSD2 (0.39) | CNR1NSD2F10CCR2CCR5 | |
| SCHEMBL4427802 | 0.90 | F10 (0.34) | CNR1CNR2F10CCR2CCR5 | |
| SCHEMBL5029465 | 0.89 | CCR2 (0.43) | CNR1NSD2CNR2HTR3APDE5A | |
| SCHEMBL4426067 | 0.84 | CNR1 (0.40) | CNR1NSD2CNR2CCR2CCR5 |
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-1606255-B1 | CYCLIC DERIVATIVES AS MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY | BRISTOL MYERS SQUIBB CO (US) | 2009-11-11 | — | — | EP | claimed |