Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.63 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.63 |
| ▸ | CCR1 | P32246 | 9/20 | 0.62 |
| ▸ | HPGD | P15428 | 1/20 | 0.59 |
| ▸ | DDR1 | Q08345 | 1/20 | 0.58 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.58 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.58 |
| ▸ | DDR2 | Q16832 | 1/20 | 0.58 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.58 |
| ▸ | MAP3K20 | Q9NYL2 | 1/20 | 0.58 |
| ▸ | MAP3K2 | Q9Y2U5 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.56 |
| ▸ | TP53 | P04637 | 1/20 | 0.56 |
| ▸ | NPC1 | O15118 | 1/20 | 0.53 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | SMO | Q99835 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL2852102 | 0.95 | ALDH1A1 (0.67) | KDM4EALDH1A1CCR1HPGDDDR1 | |
| SCHEMBL2860213 | 0.93 | KDM4E (0.73) | KDM4EALDH1A1CCR1HPGDDDR1 | |
| SCHEMBL2850153 | 0.91 | KDM4E (0.63) | KDM4EALDH1A1CCR1HPGDDDR1 | |
| SCHEMBL2850548 | 0.90 | CCR1 (0.61) | KDM4EALDH1A1CCR1DDR1MAPK11 | |
| SCHEMBL2852015 | 0.90 | CCR1 (0.63) | KDM4EALDH1A1CCR1HPGDDDR1 | |
| SCHEMBL2856181 | 0.89 | CCR1 (0.56) | KDM4EALDH1A1CCR1DDR1MAPK11 | |
| SCHEMBL2859017 | 0.89 | MAPT (0.69) | KDM4EALDH1A1CCR1DDR1MAPK11 | |
| SCHEMBL2857342 | 0.89 | CCR1 (0.60) | KDM4EALDH1A1CCR1HPGDDDR1 | |
| SCHEMBL2856191 | 0.88 | CCR1 (0.80) | KDM4EALDH1A1CCR1 | |
| SCHEMBL2855115 | 0.87 | CCR1 (0.64) | KDM4EALDH1A1CCR1 |
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 |