Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BTK | Q06187 | 16/20 | 0.44 |
| ▸ | RIPK2 | O43353 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | YES1 | P07947 | 1/20 | 0.36 |
| ▸ | LYN | P07948 | 1/20 | 0.36 |
| ▸ | RET | P07949 | 1/20 | 0.36 |
| ▸ | HCK | P08631 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | FGR | P09769 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | SRC | P12931 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | TXK | P42681 | 1/20 | 0.36 |
| ▸ | FRK | P42685 | 1/20 | 0.36 |
| ▸ | BLK | P51451 | 1/20 | 0.36 |
| ▸ | BMX | P51813 | 1/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL22418414 | 0.89 | BTK (0.55) | BTKRIPK2CYP1A2LCKFYN | |
| SCHEMBL22418418 | 0.84 | RIPK2 (0.54) | RIPK2RETHCKSRCKCNH2 | |
| SCHEMBL30441610 | 0.82 | SRC (0.43) | BTKLCKFYNLYNHCK | |
| SCHEMBL22418431 | 0.82 | SRC (0.43) | BTKLCKFYNLYNHCK | |
| SCHEMBL28675253 | 0.73 | LCK (0.39) | BTKRIPK2LCKRETSRC | |
| SCHEMBL30441512 | 0.71 | SRC (0.53) | BTKLCKFYNLYNHCK | |
| SCHEMBL22418413 | 0.71 | SRC (0.53) | BTKLCKFYNLYNHCK | |
| SCHEMBL22418463 | 0.71 | FLT3 (0.52) | RIPK2LCKSRC | |
| SCHEMBL20351550 | 0.71 | BTK (0.45) | BTKCYP1A2LCKFYNYES1 | |
| SCHEMBL28677115 | 0.70 | SRC (0.54) | BTKLCKSRCADK |
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-2020182188-A1 | SUBSTITUTED HETEROARYL COMPOUND, COMPOSITION OF SAME, AND USES THEREOF | 习峰 | 2020-09-17 | — | — | WO | disclosed |