Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SPR | P35270 | 1/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.32 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | BTK | Q06187 | 2/20 | 0.31 |
| ▸ | JAK3 | P52333 | 1/20 | 0.31 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL25849125 | 0.80 | BRD4 (0.39) | SPRBRD4CREBBPBTKJAK3 | |
| SCHEMBL25850510 | 0.80 | PDK1 (0.39) | SPRBRD4CREBBP | |
| SCHEMBL25851541 | 0.69 | HPGD (0.37) | — | |
| SCHEMBL23068992 | 0.68 | NOTUM (0.38) | ALDH1A1BTK | |
| SCHEMBL25848798 | 0.68 | NOTUM (0.42) | BRD4CREBBPTDP1 | |
| SCHEMBL25850418 | 0.68 | PRMT5 (0.32) | — | |
| SCHEMBL25844914 | 0.68 | AR (0.41) | — | |
| SCHEMBL25853202 | 0.67 | KDM4E (0.39) | SPRALDH1A1 | |
| SCHEMBL25853945 | 0.66 | GRM5 (0.37) | — | |
| SCHEMBL25853250 | 0.64 | GRM5 (0.39) | ALDH1A1 |
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 |