Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC18A3 | Q16572 | 3/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | EZH2 | Q15910 | 2/20 | 0.37 |
| ▸ | DRD2 | P14416 | 2/20 | 0.36 |
| ▸ | DRD4 | P21917 | 2/20 | 0.36 |
| ▸ | DRD3 | P35462 | 2/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.34 |
| ▸ | CCNC | P24863 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | CDC7 | O00311 | 1/20 | 0.32 |
| ▸ | CDK9 | P50750 | 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 | |
|---|---|---|---|---|
| SCHEMBL30898642 | 0.84 | EZH2 (0.45) | EZH2PDE4BCCNCCDK8HASPIN | |
| SCHEMBL30898680 | 0.80 | EZH2 (0.39) | EZH2DRD2DRD4DRD3CCNC | |
| SCHEMBL30898651 | 0.67 | EZH2 (0.48) | EZH2OPRM1OPRD1OPRK1MAPK14 | |
| SCHEMBL30898713 | 0.67 | EZH2 (0.48) | EZH2OPRM1OPRD1OPRK1MAPK14 | |
| SCHEMBL3216850 | 0.67 | GAA (0.58) | DRD3ALDH1A1POLB | |
| SCHEMBL30898611 | 0.65 | EZH2 (0.39) | EZH2CDC7CDK9MAPK14 | |
| SCHEMBL3226312 | 0.65 | ALDH1A1 (0.48) | ALDH1A1POLB | |
| SCHEMBL30898645 | 0.62 | EZH2 (0.41) | EZH2OPRM1OPRD1OPRK1MAPK14 | |
| SCHEMBL17538386 | 0.62 | NOTUM (0.74) | SLC18A3SIGMAR1HDAC1HDAC8HDAC6 | |
| SCHEMBL30616059 | 0.62 | HRH3 (0.57) | HDAC1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113330008-B | Preparation method of amide compound and application of amide compound in medicine field | 上海华汇拓医药科技有限公司 | 2024-05-07 | — | — | CN | disclosed |