Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | JAK2 | O60674 | 13/20 | 0.70 |
| ▸ | JAK3 | P52333 | 8/20 | 0.70 |
| ▸ | JAK1 | P23458 | 5/20 | 0.70 |
| ▸ | TYK2 | P29597 | 4/20 | 0.70 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.53 |
| ▸ | EGFR | P00533 | 3/20 | 0.52 |
| ▸ | IKBKB | O14920 | 2/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.51 |
| ▸ | CHUK | O15111 | 1/20 | 0.51 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.50 |
| ▸ | FLT3 | P36888 | 2/20 | 0.50 |
| ▸ | KIT | P10721 | 1/20 | 0.50 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.50 |
| ▸ | FLT1 | P17948 | 1/20 | 0.50 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.50 |
| ▸ | FLT4 | P35916 | 1/20 | 0.50 |
| ▸ | KDR | P35968 | 1/20 | 0.50 |
| ▸ | MAP3K9 | P80192 | 1/20 | 0.50 |
| ▸ | ITK | Q08881 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| Morpholine SCHEMBL28328990 | 0.91 | JAK3 (0.73) | JAK2JAK3JAK1TYK2EGFR | |
| SCHEMBL29813742 | 0.82 | JAK2 (1.00) | JAK2JAK3JAK1TYK2EGFR | |
| SCHEMBL28875992 | 0.82 | JAK2 (1.00) | JAK2JAK3JAK1TYK2EGFR | |
| SCHEMBL28875995 | 0.81 | JAK2 (0.61) | JAK2JAK3JAK1TYK2 | |
| Morpholine SCHEMBL28329002 | 0.81 | JAK3 (0.70) | JAK2JAK3JAK1TYK2EGFR | |
| Morpholine SCHEMBL11370089 | 0.80 | TGM2 (0.67) | EGFRITK | |
| SCHEMBL28875997 | 0.79 | JAK2 (0.75) | JAK2JAK3JAK1TYK2EGFR | |
| SCHEMBL29813541 | 0.77 | JAK2 (1.00) | JAK2JAK3JAK1TYK2EGFR | |
| SCHEMBL28876009 | 0.77 | JAK2 (1.00) | JAK2JAK3JAK1TYK2EGFR | |
| SCHEMBL28876012 | 0.76 | JAK3 (0.63) | JAK2JAK3JAK1TYK2EGFR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110330484-A | Replace class phenyl pyrimidine derivative as jak kinase inhibitor or its pharmaceutical salt, Preparation method and use | 中国药科大学 | 2019-10-15 | — | — | CN | claimed |
| CN-110330484-A | Replace class phenyl pyrimidine derivative as jak kinase inhibitor or its pharmaceutical salt, Preparation method and use | 中国药科大学 | 2019-10-15 | — | — | CN | disclosed |