Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 3/20 | 0.46 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.45 |
| ▸ | JAK2 | O60674 | 4/20 | 0.38 |
| ▸ | HRH1 | P35367 | 3/20 | 0.38 |
| ▸ | JAK3 | P52333 | 3/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 3/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 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 | |
|---|---|---|---|---|
| SCHEMBL30702750 | 0.75 | PAK4 (0.38) | JAK2JAK3MEN1KMT2AHSD17B10 | |
| SCHEMBL14026511 | 0.75 | PAK4 (0.38) | JAK2JAK3MEN1KMT2AHSD17B10 | |
| SCHEMBL3132389 | 0.74 | GPR39 (0.38) | GRM4JAK2MEN1KMT2AHSD17B10 | |
| SCHEMBL19796066 | 0.73 | MAPT (0.41) | MEN1KMT2AHTTPLK4PAK4 | |
| SCHEMBL91111 | 0.73 | GSK3B (0.35) | JAK2JAK3MEN1KMT2AHSD17B10 | |
| SCHEMBL31080486 | 0.71 | IGF1R (0.46) | CDK2GRM4JAK2JAK3PAK4 | |
| SCHEMBL61333 | 0.71 | KMT2A (0.53) | MEN1KMT2AHTTKDM4EALDH1A1 | |
| SCHEMBL12965683 | 0.70 | CDK2 (0.46) | CDK2GRM4JAK2HRH1JAK3 | |
| SCHEMBL63682 | 0.69 | AURKA (0.46) | JAK2JAK3MEN1KMT2AHSD17B10 | |
| SCHEMBL61956 | 0.69 | GSK3B (0.32) | JAK2JAK3PAK4CSF1R |
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-2004004730-A2 | 2-AMINOPYRAZINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASES FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTEX TECHNOLOGY LIMITED (GB) | 2004-01-15 | — | — | WO | claimed |
| WO-2004004730-A2 | 2-AMINOPYRAZINE DERIVATIVES AS INHIBITORS OF CYCLIN DEPENDENT KINASES FOR THE TREATMENT OF PROLIFERATIVE DISORDERS | ASTEX TECHNOLOGY LIMITED (GB) | 2004-01-15 | — | — | WO | disclosed |