Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.51 |
| ▸ | IKBKB | O14920 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 2/20 | 0.49 |
| ▸ | PLK4 | O00444 | 1/20 | 0.49 |
| ▸ | AURKA | O14965 | 1/20 | 0.49 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.49 |
| ▸ | CHEK2 | O96017 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.49 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.49 |
| ▸ | LCK | P06239 | 1/20 | 0.49 |
| ▸ | FYN | P06241 | 1/20 | 0.49 |
| ▸ | CSF1R | P07333 | 1/20 | 0.49 |
| ▸ | LYN | P07948 | 1/20 | 0.49 |
| ▸ | KIT | P10721 | 1/20 | 0.49 |
| ▸ | FLT1 | P17948 | 1/20 | 0.49 |
| ▸ | EPHA2 | P29317 | 1/20 | 0.49 |
| ▸ | FLT4 | P35916 | 1/20 | 0.49 |
| ▸ | FLT3 | P36888 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL12907422 | 0.87 | GSK3B (0.55) | KDRPLK4AURKAROCK2CHEK2 | |
| SCHEMBL12907194 | 0.84 | PDPK1 (0.66) | HDAC1HDAC2HDAC8IKBKBKDR | |
| SCHEMBL13122227 | 0.83 | TRPA1 (0.55) | TRPA1MAP2K4MAPK1MAPK6MAPKAPK5 | |
| SCHEMBL12907457 | 0.80 | JAK2 (0.67) | KDRAURKAAURKBPDPK1MKNK1 | |
| SCHEMBL29550433 | 0.80 | KDM4E (0.50) | IKBKBPIM1NOTUMIDO1 | |
| SCHEMBL22775716 | 0.80 | KDM4E (0.50) | IKBKBPIM1NOTUMIDO1 | |
| SCHEMBL12907435 | 0.78 | CHEK1 (0.58) | KDRJAK3PDPK1JAK2GSK3B | |
| SCHEMBL12907442 | 0.76 | TRPA1 (0.60) | TRPA1MAPK1 | |
| SCHEMBL12907438 | 0.76 | GSK3B (0.54) | PDPK1NOTUMJAK2GSK3BPOLB | |
| SCHEMBL12907220 | 0.75 | JAK2 (0.65) | IKBKBKDRPLK4AURKAROCK2 |
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 |