Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 5/20 | 0.49 |
| ▸ | CHUK | O15111 | 4/20 | 0.49 |
| ▸ | IKBKG | Q9Y6K9 | 3/20 | 0.49 |
| ▸ | JAK2 | O60674 | 7/20 | 0.49 |
| ▸ | JAK3 | P52333 | 5/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.48 |
| ▸ | PIK3CB | P42338 | 2/20 | 0.48 |
| ▸ | PIK3CG | P48736 | 2/20 | 0.48 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.47 |
| ▸ | AIMP2 | Q13155 | 1/20 | 0.46 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.45 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.45 |
| ▸ | JAK1 | P23458 | 1/20 | 0.45 |
| ▸ | TYK2 | P29597 | 1/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.45 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.45 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL8311018 | 0.89 | JAK2 (0.61) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL14021629 | 0.88 | JAK2 (0.54) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL13590765 | 0.87 | JAK2 (0.51) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL14063840 | 0.87 | PIK3CA (0.52) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL4392408 | 0.86 | PIK3CA (0.51) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL3049760 | 0.86 | SYK (0.51) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL8312148 | 0.86 | CDK1 (0.62) | IKBKBCHUKJAK2JAK3PIK3CA | |
| SCHEMBL1512786 | 0.86 | PIK3CA (0.55) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL14021327 | 0.85 | JAK2 (0.49) | IKBKBCHUKIKBKGJAK2JAK3 | |
| SCHEMBL14021289 | 0.85 | CDK1 (0.51) | IKBKBCHUKIKBKGJAK2JAK3 |
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 4 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 |
| US-7429599-B2 | Methods for treating or preventing an inflammatory or metabolic condition or inhibiting JNK | SIGNAL PHARMACEUTICALS, LLC (US) | 2008-09-30 | — | — | US | disclosed |
| US-7429599-B2 | Methods for treating or preventing an inflammatory or metabolic condition or inhibiting JNK | SIGNAL PHARMACEUTICALS, LLC (US) | 2008-09-30 | — | — | US | disclosed |