Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 12/20 | 0.82 |
| ▸ | CHUK | O15111 | 9/20 | 0.82 |
| ▸ | IKBKG | Q9Y6K9 | 9/20 | 0.82 |
| ▸ | MAPK8 | P45983 | 2/20 | 0.64 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.64 |
| ▸ | MEN1 | O00255 | 1/20 | 0.64 |
| ▸ | RECQL | P46063 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.64 |
| ▸ | PRKCZ | Q05513 | 1/20 | 0.64 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.64 |
| ▸ | GSK3B | P49841 | 2/20 | 0.54 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.54 |
| ▸ | CAMKK2 | Q96RR4 | 1/20 | 0.54 |
| ▸ | AURKA | O14965 | 2/20 | 0.54 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.53 |
| ▸ | CDK2 | P24941 | 2/20 | 0.51 |
| ▸ | CDK4 | P11802 | 1/20 | 0.51 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL12423154 | 0.79 | MAPK8 (0.62) | IKBKBCHUKIKBKGMAPK8MAPK10 | |
| SCHEMBL8255815 | 0.79 | MAPK8 (0.66) | IKBKBCHUKIKBKGMAPK8MAPK10 | |
| SCHEMBL8246523 | 0.78 | MAPK8 (1.00) | IKBKBCHUKMAPK8MAPK10GSK3B | |
| SCHEMBL29392505 | 0.78 | IKBKB (1.00) | IKBKBCHUKIKBKGMEN1RECQL | |
| SCHEMBL15299484 | 0.78 | IKBKB (1.00) | IKBKBCHUKIKBKGMEN1RECQL | |
| SCHEMBL8312854 | 0.78 | MAPK8 (0.76) | IKBKBCHUKMAPK8MAPK10GSK3B | |
| Hydrochloric Acid SCHEMBL30493205 | 0.78 | IKBKB (0.98) | IKBKBCHUKIKBKGMEN1RECQL | |
| SCHEMBL4903032 | 0.77 | MAPK8 (0.74) | IKBKBMAPK8MAPK10GSK3BPIK3CG | |
| Hydrochloric Acid SCHEMBL18114519 | 0.76 | IKBKB (0.78) | IKBKBCHUKIKBKGMEN1RECQL | |
| SCHEMBL8308607 | 0.76 | MAPK8 (0.64) | IKBKBCHUKIKBKGMAPK8MAPK10 |
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 5 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 |
| WO-2004084901-A1 | METHODS FOR TREATING OR PREVENTING AN INFLAMMATORY OR METABOLIC CONDITION BY INHIBITING JNK | SIGNAL PHARMACEUTICALS, LLC (US) | 2004-10-07 | — | — | WO | disclosed |