Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMO | O15229 | 1/20 | 0.55 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | BCHE | P06276 | 1/20 | 0.44 |
| ▸ | ACHE | P22303 | 1/20 | 0.44 |
| ▸ | MAP4K4 | O95819 | 5/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.43 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.43 |
| ▸ | JAK3 | P52333 | 1/20 | 0.43 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.43 |
| ▸ | CSNK1E | P49674 | 1/20 | 0.43 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.42 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3054100 | 0.85 | CCNA2 (0.47) | KMOLMNAMAP4K4MAPK14CSNK1D | |
| SCHEMBL5263358 | 0.83 | KMO (0.42) | KMOLMNABCHEACHEMAP4K4 | |
| SCHEMBL27618727 | 0.82 | KMO (0.39) | KMOLMNAMAPK14CSNK1DJAK3 | |
| SCHEMBL5818427 | 0.82 | KDM4E (0.42) | KMOLMNAMAPK14CSNK1DJAK3 | |
| SCHEMBL3069610 | 0.81 | LMNA (0.38) | KMOLMNABCHEACHEMAPK14 | |
| SCHEMBL15229183 | 0.81 | MAP4K4 (0.48) | LMNAMAP4K4MAPK14CSNK1DJAK3 | |
| SCHEMBL30467131 | 0.81 | MAP4K4 (0.48) | LMNAMAP4K4MAPK14CSNK1DJAK3 | |
| SCHEMBL11467792 | 0.81 | LMNA (0.58) | KMOLMNAMAPK14PIK3CAKDM4E | |
| SCHEMBL21621304 | 0.80 | L3MBTL1 (0.58) | LMNAMAPK14CSNK1DJAK3PIK3CA | |
| SCHEMBL5241134 | 0.80 | CCNA2 (0.47) | LMNAMAPK14CSNK1DJAK3CCNA2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2102194-A1 | SUBSTITUTED PYRIMIDINES AND THEIR USE AS JNK MODULATORS | F. Hoffmann-Roche AG (CH) | 2009-09-23 | — | — | EP | disclosed |
| WO-2008068171-A9 | SUBSTITUTED PYRIMIDINES AND THEIR USE AS JNK MODULATORS | HOFFMANN LA ROCHE (CH) | 2009-07-16 | — | — | WO | disclosed |
| WO-2008068171-A1 | SUBSTITUTED PYRIMIDINES AND THEIR USE AS JNK MODULATORS | F. HOFFMANN-LA ROCHE AG (CH) | 2008-06-12 | — | — | WO | disclosed |