Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.39 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.39 |
| ▸ | ACHE | P22303 | 3/20 | 0.38 |
| ▸ | PSMB8 | P28062 | 1/20 | 0.35 |
| ▸ | PSMB9 | P28065 | 1/20 | 0.35 |
| ▸ | BTK | Q06187 | 7/20 | 0.34 |
| ▸ | JAK3 | P52333 | 6/20 | 0.34 |
| ▸ | SPR | P35270 | 1/20 | 0.34 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.33 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | HCK | P08631 | 1/20 | 0.33 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 0.32 |
| ▸ | OGA | O60502 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL25845232 | 0.80 | SPR (0.34) | BRD4CREBBPBTKJAK3SPR | |
| SCHEMBL25850510 | 0.77 | PDK1 (0.39) | BRD4CREBBPSPR | |
| SCHEMBL25851541 | 0.77 | HPGD (0.37) | — | |
| SCHEMBL18705999 | 0.70 | SIGMAR1 (0.47) | BRD4ACHESMYD3 | |
| SCHEMBL25848798 | 0.68 | NOTUM (0.42) | BRD4CREBBP | |
| SCHEMBL25844914 | 0.68 | AR (0.41) | — | |
| SCHEMBL25850418 | 0.68 | PRMT5 (0.32) | — | |
| SCHEMBL21893792 | 0.67 | MGLL (0.44) | — | |
| SCHEMBL21410749 | 0.67 | ACHE (0.44) | ACHEPSMB8PSMB9BTKJAK3 | |
| SCHEMBL25853250 | 0.67 | GRM5 (0.39) | — |
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-2023131122-A1 | FUSED RING-SUBSTITUTED SIX-MEMBERED HETEROCYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 劲方医药科技(上海)有限公司 | 2023-07-13 | — | — | WO | disclosed |