Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 14/20 | 0.76 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.76 |
| ▸ | IKBKB | O14920 | 4/20 | 0.76 |
| ▸ | JAK2 | O60674 | 2/20 | 0.76 |
| ▸ | MEN1 | O00255 | 1/20 | 0.76 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.76 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.76 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.76 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.76 |
| ▸ | CDK2AP1 | O14519 | 1/20 | 0.60 |
| ▸ | JAK3 | P52333 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL7055932 | 0.88 | CHEK1 (0.59) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| SCHEMBL7055087 | 0.88 | IKBKB (0.78) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| Fluorobenzene SCHEMBL27676739 | 0.87 | CHEK1 (0.71) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| SCHEMBL7055226 | 0.86 | CHEK1 (1.00) | CHEK1MAP4K4IKBKBJAK2CDK2AP1 | |
| SCHEMBL717369 | 0.86 | IKBKB (1.00) | CHEK1IKBKBJAK2MEN1EIF2AK2 | |
| SCHEMBL3086954 | 0.85 | IKBKB (0.82) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| SCHEMBL28374187 | 0.84 | IKBKB (0.76) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| SCHEMBL5898657 | 0.82 | IKBKB (0.76) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| SCHEMBL7054417 | 0.81 | TUBB4A (0.58) | CHEK1MAP4K4IKBKBJAK2MEN1 | |
| SCHEMBL4215417 | 0.80 | CHEK1 (0.70) | CHEK1MAP4K4IKBKBJAK2MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2003029241-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | claimed |
| WO-2003029241-A1 | CHK1 KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2003-04-10 | — | — | WO | disclosed |