Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 1/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.49 |
| ▸ | CCR1 | P32246 | 3/20 | 0.49 |
| ▸ | HPGD | P15428 | 3/20 | 0.48 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.48 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.48 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.48 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.48 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.48 |
| ▸ | MAP3K20 | Q9NYL2 | 1/20 | 0.48 |
| ▸ | MAP3K2 | Q9Y2U5 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | MALT1 | Q9UDY8 | 3/20 | 0.44 |
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2859043 | 0.91 | CCR1 (0.62) | ALDH1A1CCR1HPGDMAPK14MALT1 | |
| SCHEMBL2860320 | 0.90 | CCR1 (0.52) | HTTKDM4EALDH1A1CCR1MALT1 | |
| SCHEMBL2854304 | 0.90 | NPC1 (0.49) | GAAKDM4EALDH1A1CCR1HPGD | |
| SCHEMBL2855247 | 0.88 | CCR1 (0.49) | CCR1HPGDDDR1MAPK11MAPK14 | |
| SCHEMBL2855062 | 0.84 | CCR1 (0.65) | KDM4EALDH1A1CCR1HPGDDDR1 | |
| SCHEMBL2856256 | 0.84 | MAPT (0.61) | HTTKDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL2863137 | 0.83 | GAA (0.44) | GAAHTTCCR1HPGDCYP1A2 | |
| SCHEMBL2855124 | 0.83 | KDM4E (0.47) | KDM4EALDH1A1KMT2AMALT1MAPT | |
| SCHEMBL2852100 | 0.82 | MAPK11 (0.49) | KDM4EALDH1A1DDR1MAPK11MAPK14 | |
| SCHEMBL2860213 | 0.81 | KDM4E (0.73) | KDM4EALDH1A1CCR1HPGDDDR1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | claimed |
| EP-1451160-B1 | PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN | ICAGEN INC (US) | 2010-01-13 | — | — | EP | disclosed |