Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RET | P07949 | 2/20 | 0.38 |
| ▸ | LRRK2 | Q5S007 | 2/20 | 0.38 |
| ▸ | PI4KA | P42356 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.38 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.38 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.38 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | GSK3A | P49840 | 1/20 | 0.34 |
| ▸ | GSK3B | P49841 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 5/20 | 0.32 |
| ▸ | PDPK1 | O15530 | 4/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.31 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.31 |
| ▸ | PAK4 | O96013 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL11927605 | 0.78 | — | — | |
| SCHEMBL14044896 | 0.76 | NOS3 (0.47) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL30440210 | 0.76 | RET (0.38) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL12466822 | 0.76 | IDO1 (0.46) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL175432 | 0.76 | RET (0.38) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL1585071 | 0.76 | DYRK1A (0.55) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL30508312 | 0.76 | DYRK1A (0.55) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL12721812 | 0.74 | CHEK1 (0.41) | GSK3AGSK3BCHEK1AURKA | |
| SCHEMBL7216007 | 0.73 | RET (0.36) | RETLRRK2PI4KAXDHPI4K2B | |
| SCHEMBL12515294 | 0.73 | HAO1 (0.37) | GSK3AGSK3BPRKAA1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011044157-A1 | HETEROCYCLIC COMPOUNDS USEFUL AS PDK1 INHIBITORS | BIOGEN IDEC MA INC. (US) | 2011-04-14 | — | — | WO | disclosed |