Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 4/20 | 0.45 |
| ▸ | EGFR | P00533 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | JAK3 | P52333 | 1/20 | 0.45 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.45 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.45 |
| ▸ | ERBB4 | Q15303 | 1/20 | 0.45 |
| ▸ | MAPK13 | O15264 | 4/20 | 0.42 |
| ▸ | MAPK12 | P53778 | 4/20 | 0.42 |
| ▸ | MAPK11 | Q15759 | 4/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 4/20 | 0.42 |
| ▸ | MAPK9 | P45984 | 3/20 | 0.42 |
| ▸ | CPT2 | P23786 | 2/20 | 0.40 |
| ▸ | CPT1A | P50416 | 2/20 | 0.40 |
| ▸ | CPT1B | Q92523 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 5/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.39 |
| ▸ | RAF1 | P04049 | 1/20 | 0.39 |
| ▸ | F2R | P25116 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8491343 | 0.90 | BTK (0.45) | BTKMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL8485395 | 0.89 | BTK (0.44) | BTKMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL6171325 | 0.87 | MAPK13 (0.48) | BTKEGFRCYP3A4BRAFJAK3 | |
| SCHEMBL8603751 | 0.86 | BTK (0.47) | BTKMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL8604095 | 0.86 | BTK (0.47) | BTKMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL8488703 | 0.86 | BTK (0.41) | BTKEGFRCYP3A4BRAFJAK3 | |
| SCHEMBL8487974 | 0.85 | CPT2 (0.43) | BTKEGFRCYP3A4BRAFJAK3 | |
| SCHEMBL8484217 | 0.85 | MAPK14 (0.62) | BTKMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL8488861 | 0.83 | BTK (0.43) | BTKMAPK13MAPK12MAPK11MAPK14 | |
| SCHEMBL8488352 | 0.82 | BTK (0.44) | BTKMAPK13MAPK12MAPK11MAPK14 |
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 |
|---|---|---|---|---|---|---|---|
| US-5859041-A | Substituted imidazoles having cytokine inhibitory activity | MERCK & CO., INC. (US) | 1999-01-12 | — | — | US | disclosed |