Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 11/20 | 0.82 |
| ▸ | JAK2 | O60674 | 10/20 | 0.82 |
| ▸ | JAK3 | P52333 | 9/20 | 0.82 |
| ▸ | JAK1 | P23458 | 8/20 | 0.82 |
| ▸ | TYK2 | P29597 | 4/20 | 0.82 |
| ▸ | RET | P07949 | 4/20 | 0.82 |
| ▸ | FLT3 | P36888 | 4/20 | 0.82 |
| ▸ | BRDT | Q58F21 | 3/20 | 0.82 |
| ▸ | WEE1 | P30291 | 3/20 | 0.82 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.82 |
| ▸ | AXL | P30530 | 3/20 | 0.82 |
| ▸ | ABL1 | P00519 | 3/20 | 0.82 |
| ▸ | EGFR | P00533 | 3/20 | 0.82 |
| ▸ | LCK | P06239 | 3/20 | 0.82 |
| ▸ | FYN | P06241 | 3/20 | 0.82 |
| ▸ | LYN | P07948 | 3/20 | 0.82 |
| ▸ | FGFR1 | P11362 | 3/20 | 0.82 |
| ▸ | SRC | P12931 | 3/20 | 0.82 |
| ▸ | RPS6KB1 | P23443 | 3/20 | 0.82 |
| ▸ | KDR | P35968 | 3/20 | 0.82 |
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 | |
|---|---|---|---|---|
| SCHEMBL16985210 | 0.93 | BRD4 (0.84) | BRD4JAK2JAK3JAK1TYK2 | |
| SCHEMBL264158 | 0.92 | JAK3 (0.79) | BRD4JAK2JAK3JAK1TYK2 | |
| SCHEMBL30381504 | 0.92 | JAK3 (0.79) | BRD4JAK2JAK3JAK1TYK2 | |
| SCHEMBL20285974 | 0.91 | JAK2 (0.81) | BRD4JAK2JAK3JAK1TYK2 | |
| SCHEMBL28489539 | 0.91 | BRD4 (0.81) | BRD4JAK2JAK3JAK1TYK2 | |
| Fedratinib SCHEMBL263741 | 0.90 | BRD4 (1.00) | BRD4JAK2JAK3JAK1TYK2 | |
| Fedratinib SCHEMBL29351417 | 0.90 | BRD4 (1.00) | BRD4JAK2JAK3JAK1TYK2 | |
| Fedratinib SCHEMBL2734027 | 0.90 | BRD4 (0.98) | BRD4JAK2JAK3JAK1TYK2 | |
| SCHEMBL13868200 | 0.90 | BRD4 (0.79) | BRD4JAK2JAK3JAK1TYK2 | |
| Fedratinib SCHEMBL21773035 | 0.89 | BRD4 (0.91) | BRD4JAK2JAK3JAK1TYK2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019173224-A1 | DEUTERATED COMPOUNDS AND CHIMERAS AND USES THEREOF | BIOTHERYX, INC. (US) | 2019-09-12 | — | — | WO | disclosed |
| WO-2019040274-A1 | ETHER COMPOUNDS AND USES THEREOF | BIOTHERYX, INC. (US) | 2019-02-28 | — | — | WO | disclosed |
| WO-2018118947-A1 | THIENOPYRROLE DERIVATIVES FOR USE IN TARGETING PROTEINS, COMPOSITIONS, METHODS, AND USES THEREOF | BIOTHERYX, INC. (US) | 2018-06-28 | — | — | WO | disclosed |