Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | OPRK1 | P41145 | 4/20 | 0.46 |
| ▸ | BACE1 | P56817 | 2/20 | 0.46 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.46 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.44 |
| ▸ | HTR2C | P28335 | 1/20 | 0.44 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.44 |
| ▸ | ENPP2 | Q13822 | 2/20 | 0.44 |
| ▸ | ATXN2 | Q99700 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | SCN5A | Q14524 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL30898607 | 1.00 | SMN1; SMN2 (0.46) | SMN1; SMN2CYP2C19OPRK1BACE1MEN1 | |
| SCHEMBL6247721 | 0.87 | BACE1 (0.56) | SMN1; SMN2CYP2C19OPRK1BACE1MEN1 | |
| SCHEMBL3156202 | 0.81 | HDAC1 (0.46) | SMN1; SMN2CYP2C19OPRK1MEN1KMT2A | |
| SCHEMBL2075657 | 0.81 | IP6K1 (0.46) | OPRK1MEN1KMT2AHTR1AGAA | |
| SCHEMBL4269990 | 0.81 | BACE1 (0.54) | SMN1; SMN2CYP2C19OPRK1BACE1MEN1 | |
| SCHEMBL4269987 | 0.81 | BACE1 (0.54) | SMN1; SMN2CYP2C19OPRK1BACE1MEN1 | |
| SCHEMBL30468565 | 0.80 | OPRM1 (0.45) | CYP2C19OPRK1MEN1KMT2AOPRD1 | |
| SCHEMBL21904386 | 0.80 | OPRM1 (0.45) | CYP2C19OPRK1MEN1KMT2AOPRD1 | |
| SCHEMBL1233346 | 0.78 | GPR119 (0.41) | BACE1KDM4EMAPT | |
| SCHEMBL30312968 | 0.78 | GPR119 (0.41) | BACE1KDM4EMAPT |
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-2020192652-A1 | PREPARATION METHOD FOR AMIDE COMPOUNDS AND USE THEREOF IN MEDICAL FIELD | 上海华汇拓医药科技有限公司 | 2020-10-01 | — | — | WO | disclosed |