Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 4/20 | 0.54 |
| ▸ | CHUK | O15111 | 3/20 | 0.54 |
| ▸ | IKBKG | Q9Y6K9 | 2/20 | 0.54 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.54 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.54 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.54 |
| ▸ | MTOR | P42345 | 1/20 | 0.52 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.52 |
| ▸ | JAK2 | O60674 | 3/20 | 0.51 |
| ▸ | GRM5 | P41594 | 4/20 | 0.50 |
| ▸ | CAMK2D | Q13557 | 3/20 | 0.50 |
| ▸ | CDK1 | P06493 | 1/20 | 0.49 |
| ▸ | CDK2 | P24941 | 1/20 | 0.49 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.49 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.49 |
| ▸ | JAK1 | P23458 | 1/20 | 0.49 |
| ▸ | TYK2 | P29597 | 1/20 | 0.49 |
| ▸ | JAK3 | P52333 | 1/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL11924733 | 0.93 | MTOR (0.60) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL14021190 | 0.93 | MTOR (0.60) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL14021219 | 0.92 | PIK3CA (0.58) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL14063828 | 0.90 | CAMK2D (0.61) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL8312148 | 0.89 | CDK1 (0.62) | IKBKBCHUKPIK3CAPIK3CBPIK3CG | |
| SCHEMBL1512786 | 0.89 | PIK3CA (0.55) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL14021253 | 0.88 | IKBKB (0.52) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL7020880 | 0.88 | PIK3CA (0.56) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL14021310 | 0.88 | SYK (0.53) | IKBKBCHUKIKBKGPIK3CAPIK3CB | |
| SCHEMBL5070960 | 0.87 | IKBKB (0.64) | IKBKBCHUKIKBKGPIK3CAPIK3CB |
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 |
|---|---|---|---|---|---|---|---|
| US-7442699-B2 | Anilinopyrimidine derivatives as IKK inhibitors and compositions and methods related thereto | SIGNAL PHARMACEUTICALS, LLC (US) | 2008-10-28 | — | — | US | disclosed |
| US-7442699-B2 | Anilinopyrimidine derivatives as IKK inhibitors and compositions and methods related thereto | SIGNAL PHARMACEUTICALS, LLC (US) | 2008-10-28 | — | — | US | disclosed |