Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 10/20 | 0.46 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.46 |
| ▸ | CDK2 | P24941 | 2/20 | 0.45 |
| ▸ | CDK1 | P06493 | 1/20 | 0.45 |
| ▸ | IKBKB | O14920 | 3/20 | 0.44 |
| ▸ | CHUK | O15111 | 3/20 | 0.44 |
| ▸ | IKBKG | Q9Y6K9 | 3/20 | 0.44 |
| ▸ | MYLK4 | Q86YV6 | 2/20 | 0.42 |
| ▸ | STK17A | Q9UEE5 | 2/20 | 0.42 |
| ▸ | NEK3 | P51956 | 2/20 | 0.42 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.42 |
| ▸ | NEK5 | Q6P3R8 | 1/20 | 0.42 |
| ▸ | MTOR | P42345 | 1/20 | 0.42 |
| ▸ | SMG1 | Q96Q15 | 1/20 | 0.42 |
| ▸ | JAK3 | P52333 | 5/20 | 0.41 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.40 |
| ▸ | PLK4 | O00444 | 2/20 | 0.39 |
| ▸ | JAK1 | P23458 | 2/20 | 0.39 |
| ▸ | TYK2 | P29597 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8313394 | 0.98 | IKBKB (0.46) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL14063854 | 0.95 | CDK2 (0.46) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL8309514 | 0.91 | JAK2 (0.45) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL14063861 | 0.90 | IKBKB (0.47) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL14063869 | 0.89 | CDK1 (0.44) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL14021551 | 0.88 | NOS3 (0.44) | NOS3NOS1 | |
| SCHEMBL14021585 | 0.87 | CDK1 (0.53) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL5070979 | 0.86 | IKBKB (0.47) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL14021233 | 0.86 | CDK1 (0.49) | JAK2HDAC1HDAC6CDK2CDK1 | |
| SCHEMBL8313335 | 0.84 | IKBKB (0.49) | JAK2HDAC1HDAC6CDK2CDK1 |
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 |