Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRIN2D | O15399 | 1/20 | 0.43 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.43 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.43 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.41 |
| ▸ | ERN1 | O75460 | 2/20 | 0.40 |
| ▸ | ESR1 | P03372 | 2/20 | 0.40 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.40 |
| ▸ | ACMSD | Q8TDX5 | 3/20 | 0.39 |
| ▸ | HNF4A | P41235 | 2/20 | 0.39 |
| ▸ | DHFR | P00374 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.39 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL27689931 | 0.76 | RXFP1 (0.54) | GRIN2AGRIN2BGRIN2CERN1MEN1 | |
| SCHEMBL1800146 | 0.75 | CYP1A2 (0.52) | NR4A2MEN1KMT2ARXFP1GPR84 | |
| SCHEMBL28756416 | 0.73 | RXFP1 (0.70) | ERN1MEN1KMT2ARXFP1ALDH1A1 | |
| SCHEMBL28037110 | 0.73 | ALDH1A1 (0.50) | GRIN2DGRIN2AGRIN2BGRIN2CERN1 | |
| SCHEMBL11568765 | 0.72 | ACMSD (0.49) | MEN1KMT2AACMSDHNF4ADHFR | |
| SCHEMBL11312027 | 0.72 | GSTA1 (0.53) | ACMSDHNF4ADHFRMCL1ALDH1A1 | |
| SCHEMBL11530588 | 0.72 | ACMSD (0.49) | MEN1KMT2AACMSDHNF4ADHFR | |
| SCHEMBL27459568 | 0.72 | PRKAB2 (0.50) | NR4A2GPR84ALDH1A1TDP1 | |
| SCHEMBL28847737 | 0.70 | ESR1 (0.53) | ESR1ESR2GPR84DHFRALDH1A1 | |
| SCHEMBL19558296 | 0.70 | ESR1 (0.50) | ESR1ESR2GPR84DHFRALDH1A1 |
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-118271247-A | AIE type I photosensitizer, nanoparticle, preparation method and application thereof in antibiosis | 广州医科大学 | 2024-07-02 | — | — | CN | claimed |
| CN-118271247-A | AIE type I photosensitizer, nanoparticle, preparation method and application thereof in antibiosis | 广州医科大学 | 2024-07-02 | — | — | CN | disclosed |