Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IKBKB | O14920 | 3/20 | 0.52 |
| ▸ | JAK2 | O60674 | 2/20 | 0.52 |
| ▸ | JAK3 | P52333 | 1/20 | 0.52 |
| ▸ | CHEK1 | O14757 | 10/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4312138 | 1.00 | IKBKB (0.52) | IKBKBJAK2JAK3CHEK1MAP4K4 | |
| SCHEMBL3808348 | 0.94 | IKBKB (0.50) | IKBKBJAK2JAK3CHEK1MEN1 | |
| SCHEMBL3808343 | 0.94 | IKBKB (0.50) | IKBKBJAK2JAK3CHEK1MEN1 | |
| SCHEMBL1148191 | 0.87 | CHEK1 (0.45) | IKBKBJAK2JAK3CHEK1MEN1 | |
| SCHEMBL1148190 | 0.87 | CHEK1 (0.45) | IKBKBJAK2JAK3CHEK1MEN1 | |
| SCHEMBL1147736 | 0.83 | IKBKB (0.61) | IKBKBJAK2JAK3CHEK1MAP4K4 | |
| SCHEMBL11921492 | 0.83 | IKBKB (0.61) | IKBKBJAK2JAK3CHEK1MAP4K4 | |
| SCHEMBL1147725 | 0.83 | IKBKB (0.61) | IKBKBJAK2JAK3CHEK1MAP4K4 | |
| SCHEMBL490600 | 0.81 | CHEK1 (0.47) | IKBKBJAK2JAK3CHEK1MEN1 | |
| SCHEMBL490597 | 0.81 | CHEK1 (0.47) | IKBKBJAK2JAK3CHEK1MEN1 |
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-2297128-B1 | INHIBITORS OF IKK- SERINE-THREONINE PROTEIN KINASE | CHROMA THERAPEUTICS LTD (GB) | 2012-08-15 | — | — | EP | disclosed |
| WO-2009130434-A1 | INHIBITORS OF IKK-β SERINE-THREONINE PROTEIN KINASE | CHROMA THERAPEUTICS LTD. (GB) | 2009-10-29 | — | — | WO | disclosed |