Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 3/20 | 0.48 |
| ▸ | KDR | P35968 | 3/20 | 0.48 |
| ▸ | CDK4 | P11802 | 2/20 | 0.48 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.48 |
| ▸ | CCND1 | P24385 | 2/20 | 0.48 |
| ▸ | CDK2 | P24941 | 2/20 | 0.48 |
| ▸ | CCND3 | P30281 | 2/20 | 0.48 |
| ▸ | BRD4 | O60885 | 4/20 | 0.46 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.45 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.45 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.42 |
| ▸ | JAK2 | O60674 | 1/20 | 0.41 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.41 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.41 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL12907412 | 0.90 | BRD4 (0.46) | CHEK1KDRCDK4CCNA2CCND1 | |
| SCHEMBL12907191 | 0.85 | JAK2 (0.60) | CHEK1KDRCDK4CCNA2CCND1 | |
| SCHEMBL12907469 | 0.83 | JAK2 (0.53) | CHEK1KDRCDK4CCNA2CCND1 | |
| SCHEMBL16576449 | 0.79 | KDR (0.59) | CHEK1KDRCDK4CCND1CCND3 | |
| SCHEMBL12907173 | 0.77 | JAK2 (0.60) | KDRCDK2SCN9ASCN5AJAK2 | |
| SCHEMBL12907457 | 0.77 | JAK2 (0.67) | CHEK1KDRCDK4CCNA2CCND1 | |
| SCHEMBL12907427 | 0.76 | QPCT (0.49) | CHEK1KDRCDK4CCNA2CCND1 | |
| SCHEMBL27805305 | 0.75 | CHEK1 (0.43) | CHEK1KDRFGFR1 | |
| SCHEMBL12907442 | 0.73 | TRPA1 (0.60) | SCN9ASCN5A | |
| SCHEMBL18190547 | 0.72 | BRD4 (0.50) | BRD4PTGS2ABL1TNKS2FFAR4 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7872039-B2 | N-3-chlorobenzyl-3-amino-1H-indazole-5-carboxamide; 3-aminoindazoles; glucocorticoid-depedent kinase (SGK) inhibitors; SGK-induced diseases; diabetes, obesity, metabolic syndrome (dyslipidaemia), systemic and pulmonary hypertonia, cardiovascular diseases and renal diseases, fibrosis; inflammatory agents | MERCK PATENT GESELLSCHAFT (DE) | 2011-01-18 | — | — | US | disclosed |