Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 11/20 | 0.61 |
| ▸ | ITK | Q08881 | 4/20 | 0.61 |
| ▸ | TGM2 | P21980 | 1/20 | 0.49 |
| ▸ | BTK | Q06187 | 3/20 | 0.48 |
| ▸ | JAK2 | O60674 | 1/20 | 0.48 |
| ▸ | LYN | P07948 | 1/20 | 0.48 |
| ▸ | TEC | P42680 | 1/20 | 0.48 |
| ▸ | TXK | P42681 | 1/20 | 0.48 |
| ▸ | BMX | P51813 | 1/20 | 0.48 |
| ▸ | JAK3 | P52333 | 1/20 | 0.48 |
| ▸ | CD69 | Q07108 | 1/20 | 0.48 |
| ▸ | NPC1 | O15118 | 3/20 | 0.47 |
| ▸ | RAB9A | P51151 | 3/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28524018 | 0.87 | EGFR (0.49) | EGFRITKTGM2NPC1RAB9A | |
| SCHEMBL28519662 | 0.86 | EGFR (0.50) | EGFRITKTGM2NPC1RAB9A | |
| SCHEMBL4197685 | 0.84 | RAB9A (0.63) | EGFRITKTGM2NPC1RAB9A | |
| SCHEMBL27961476 | 0.83 | KMT2A (0.51) | NPC1RAB9AMAPTKDM4EMEN1 | |
| SCHEMBL28310060 | 0.80 | TGM2 (0.67) | EGFRITKTGM2BTKJAK2 | |
| SCHEMBL14791196 | 0.80 | EGFR (0.74) | EGFRITKBTKJAK2LYN | |
| SCHEMBL28463718 | 0.80 | EGFR (0.63) | EGFRITKTGM2BTKJAK2 | |
| SCHEMBL12519520 | 0.78 | EGFR (1.00) | EGFRITKBTKJAK2LYN | |
| SCHEMBL28450293 | 0.77 | EGFR (0.58) | EGFRITKTGM2BTKJAK2 | |
| SCHEMBL28455574 | 0.77 | EGFR (0.58) | EGFRITKTGM2BTKJAK2 |
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-112409360-B | Heteroaryl vinyl xanthine derivatives and uses thereof | 广东东阳光药业有限公司 | 2022-12-23 | — | — | CN | disclosed |
| CN-112409360-A | Heteroaryl vinyl xanthine derivatives and uses thereof | 广东东阳光药业有限公司 | 2021-02-26 | — | — | CN | disclosed |