Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.53 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.43 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 3/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.37 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.36 |
| ▸ | HCRTR1 | O43613 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | CNR1 | P21554 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.35 |
| ▸ | PPARG | P37231 | 1/20 | 0.35 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | PPARA | Q07869 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27693276 | 0.90 | KDM4E (0.41) | KDM4EMRGPRX4CXCR2GAAPOLB | |
| SCHEMBL485344 | 0.85 | KDM4E (0.52) | KDM4EMRGPRX4CXCR2GAAPOLB | |
| SCHEMBL485692 | 0.77 | MRGPRX4 (0.55) | KDM4EMRGPRX4CXCR2 | |
| SCHEMBL485491 | 0.76 | CXCR2 (0.44) | KDM4EMRGPRX4CXCR2GAAPOLB | |
| SCHEMBL485706 | 0.75 | CXCR2 (0.44) | KDM4EMRGPRX4CXCR2GAAPOLB | |
| SCHEMBL10289725 | 0.75 | KDM4E (0.50) | KDM4ECXCR2P2RX7 | |
| SCHEMBL5179473 | 0.73 | KDM4E (0.51) | KDM4EMRGPRX4CXCR2GAAPOLB | |
| SCHEMBL485303 | 0.72 | KDM4E (0.52) | KDM4EMRGPRX4CXCR2P2RX7TRPM8 | |
| SCHEMBL485816 | 0.72 | KDM4E (0.52) | KDM4EMRGPRX4CXCR2 | |
| SCHEMBL485152 | 0.72 | KDM4E (0.53) | KDM4EMRGPRX4CXCR2P2RX7ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101094830-A | Fused bicyclic carboxamide derivatives for use as CXCR2 inhibitors in the treatment of inflammation | SANOFI AVENTIS DEUTSCHLAND (DE) | 2007-12-26 | — | — | CN | claimed |