Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK2 | O96017 | 2/20 | 0.55 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.41 |
| ▸ | PDE3A | Q14432 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 3/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL217152 | 0.82 | CHEK2 (0.47) | CHEK2FGFR1KDM4EALDH1A1PDE3B | |
| SCHEMBL215076 | 0.79 | CHEK2 (0.47) | CHEK2FGFR1FLT1PARP1KDM4E | |
| SCHEMBL215874 | 0.79 | CHEK2 (0.65) | CHEK2FGFR1FLT1HRH3PARP1 | |
| SCHEMBL215870 | 0.77 | CHEK2 (0.45) | CHEK2FGFR1FLT1PARP1KDM4E | |
| SCHEMBL216182 | 0.75 | DRD3 (0.41) | CHEK2PARP1LTA4H | |
| SCHEMBL214316 | 0.75 | BTK (0.42) | FGFR1LTA4HKDM4E | |
| SCHEMBL215459 | 0.75 | CHEK2 (0.46) | CHEK2FGFR1FLT1PARP1KDM4E | |
| Hydrochloric Acid SCHEMBL215262 | 0.75 | ITGB3 (0.41) | CHEK2PARP1LTA4H | |
| SCHEMBL214859 | 0.74 | CHEK2 (0.47) | CHEK2PARP1LTA4HKDM4EACHE | |
| SCHEMBL216428 | 0.74 | ITGB3 (0.38) | CHEK2HRH3PARP1LTA4HALDH1A1 |
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-8088767-B2 | JAK-2 modulators and methods of use | EXELIXIS, INC. (US) | 2012-01-03 | — | — | US | disclosed |