Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK1 | P23458 | 9/20 | 0.41 |
| ▸ | JAK2 | O60674 | 7/20 | 0.39 |
| ▸ | TYK2 | P29597 | 4/20 | 0.39 |
| ▸ | PTK2 | Q05397 | 4/20 | 0.38 |
| ▸ | JAK3 | P52333 | 2/20 | 0.37 |
| ▸ | ITK | Q08881 | 2/20 | 0.36 |
| ▸ | CA12 | O43570 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 3/20 | 0.36 |
| ▸ | CA9 | Q16790 | 3/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL21953290 | 0.92 | PTK2 (0.40) | JAK1JAK2TYK2PTK2JAK3 | |
| SCHEMBL16246167 | 0.80 | ITK (0.46) | JAK1JAK2TYK2JAK3ITK | |
| SCHEMBL16245556 | 0.80 | JAK2 (0.44) | JAK1JAK2TYK2JAK3HDAC1 | |
| SCHEMBL21953820 | 0.78 | PTK2 (0.43) | JAK1JAK2TYK2PTK2JAK3 | |
| SCHEMBL16245576 | 0.78 | EGFR (0.46) | JAK1JAK2TYK2PTK2JAK3 | |
| SCHEMBL16245707 | 0.76 | EIF2AK4 (0.47) | JAK1JAK2TYK2JAK3ITK | |
| SCHEMBL21953299 | 0.73 | STK17B (0.48) | PTK2ITKCA12CA1CA2 | |
| SCHEMBL21953819 | 0.72 | CYSLTR2 (0.42) | PTK2 | |
| SCHEMBL16246173 | 0.71 | ITK (0.54) | JAK1JAK2TYK2JAK3ITK | |
| SCHEMBL18869218 | 0.71 | JAK1 (0.41) | JAK1JAK2TYK2JAK3 |
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-2020085742-A1 | HETEROAROMATIC MACROCYCLIC DERIVATIVES AS PROTEIN KINASE INHIBITORS | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2020-04-30 | — | — | WO | disclosed |