Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 1/20 | 0.38 |
| ▸ | CHUK | O15111 | 1/20 | 0.38 |
| ▸ | CDK2 | P24941 | 7/20 | 0.37 |
| ▸ | CDK4 | P11802 | 5/20 | 0.37 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 2/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.34 |
| ▸ | CA1 | P00915 | 2/20 | 0.34 |
| ▸ | CA2 | P00918 | 2/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | PRKCI | P41743 | 1/20 | 0.34 |
| ▸ | IGF1R | P08069 | 2/20 | 0.33 |
| ▸ | FAM20C | Q8IXL6 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4441619 | 0.82 | IKBKB (0.42) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL14020182 | 0.77 | IKBKB (0.47) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL3979898 | 0.75 | MEN1 (0.42) | CDK2CDK4CCNE1KDRSYK | |
| SCHEMBL4622742 | 0.74 | IKBKB (0.49) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL14020190 | 0.74 | CDK2 (0.38) | IKBKBCHUKCDK2CDK4CCNE1 | |
| Hydrochloric Acid SCHEMBL4880086 | 0.73 | IKBKB (0.49) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL3300483 | 0.73 | IKBKB (0.43) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL14020201 | 0.73 | CDK2 (0.38) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL4623096 | 0.72 | CDK2 (0.47) | IKBKBCHUKCDK2CDK4CCNE1 | |
| SCHEMBL3980488 | 0.72 | IKBKB (0.43) | IKBKBCHUKCDK2CDK4CCNE1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2118092-A1 | NEW N, N'- 2,4-DIANILINOPYRIMIDINE DERIVATIVES, PREPARATION THEREOF AS DRUGS, PHARMACEUTICAL COMPOSITIONS ESSENTIALLY AS IKK INHIBITORS | Sanofi-Aventis (FR) | 2009-11-18 | — | — | EP | disclosed |
| WO-2008099073-A1 | N, N' -2, 4-DIANILINOPYRIMIDINES PREPARATION AND USE THEREOF AS IKK INHIBITORS PREPARATION AND TEH PHARMACUETICAL COMPOSITIONS THEREOF | SANOFI-AVENTIS (FR) | 2008-08-21 | — | — | WO | disclosed |