Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 4/20 | 0.40 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.40 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.38 |
| ▸ | PLA2G7 | Q13093 | 1/20 | 0.36 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | KDM1A | O60341 | 1/20 | 0.36 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.35 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.35 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | IDO1 | P14902 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| SCHEMBL4093729 | 0.93 | CHEK1 (0.44) | CHEK1CDK2AP1DYRK1AHDAC1HDAC6 | |
| SCHEMBL4088527 | 0.84 | GAA (0.43) | DYRK1AALOX15PIK3CGPIK3CDPIK3CA | |
| SCHEMBL6611782 | 0.81 | IKBKB (0.47) | CHEK1CDK2AP1HDAC6JAK2 | |
| SCHEMBL6613610 | 0.78 | MEN1 (0.46) | ALOX15KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL14679555 | 0.67 | TRPA1 (0.40) | HDAC1HDAC6EGLN2HDAC2 | |
| SCHEMBL5898678 | 0.67 | JAK2 (0.57) | CHEK1JAK2 | |
| SCHEMBL1382705 | 0.66 | IKBKB (0.69) | CHEK1CDK2AP1HDAC6JAK2 | |
| SCHEMBL8351467 | 0.66 | ALDH1A1 (0.44) | KDM4EALDH1A1LMNAMAPT | |
| SCHEMBL13235766 | 0.65 | SMN1; SMN2 (0.70) | EGLN2KDM1AIDO1KDM4EALDH1A1 | |
| SCHEMBL7057002 | 0.65 | IKBKB (0.53) | CHEK1CDK2AP1HDAC6JAK2 |
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-1261600-B1 | HETEROAROMATIC CARBOXAMIDE DERIVATIVES AND THEIR USE AS INHIBITORS OF THE ENZYME IKK-2 | ASTRAZENECA AB (SE) | 2004-05-06 | — | — | EP | disclosed |