Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MBOAT4 | Q96T53 | 1/20 | 0.33 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.32 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.31 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.31 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.31 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.31 |
| ▸ | TRPM5 | Q9NZQ8 | 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 | |
|---|---|---|---|---|
| SCHEMBL28946553 | 0.78 | NOS2 (0.40) | — | |
| SCHEMBL28803056 | 0.77 | — | — | |
| SCHEMBL28803087 | 0.73 | MEN1 (0.36) | LIPGADORA2ACYP4F2CYP4A11 | |
| SCHEMBL27813484 | 0.73 | PARP1 (0.50) | ADORA2A | |
| SCHEMBL28946577 | 0.72 | TBXAS1 (0.46) | — | |
| SCHEMBL28445294 | 0.70 | MEN1 (0.40) | ADORA2A | |
| SCHEMBL29202909 | 0.69 | MEN1 (0.34) | ADORA2ACYP4F2CYP4A11 | |
| SCHEMBL14842178 | 0.68 | MEN1 (0.41) | ADORA2A | |
| SCHEMBL27961424 | 0.67 | MEN1 (0.40) | ADORA2A | |
| SCHEMBL10768300 | 0.66 | MEN1 (0.52) | — |
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-114805334-B | QC and GSK-3 beta multi-targeting inhibitor and preparation method and application thereof | 深圳大学 | 2023-06-09 | — | — | CN | disclosed |
| CN-114805334-A | QC and GSK-3 beta multi-target inhibitor and preparation method and application thereof | 深圳大学 | 2022-07-29 | — | — | CN | disclosed |