Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 1/20 | 0.63 |
| ▸ | FFAR1 | O14842 | 5/20 | 0.61 |
| ▸ | PTPRB | P23467 | 1/20 | 0.59 |
| ▸ | CDC25A | P30304 | 1/20 | 0.59 |
| ▸ | CDC25B | P30305 | 1/20 | 0.59 |
| ▸ | PTEN | P60484 | 1/20 | 0.59 |
| ▸ | PTPMT1 | Q8WUK0 | 1/20 | 0.59 |
| ▸ | DRD2 | P14416 | 1/20 | 0.57 |
| ▸ | DRD1 | P21728 | 1/20 | 0.57 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.57 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.55 |
| ▸ | IDO1 | P14902 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.52 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.52 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.52 |
| ▸ | PLA2G4A | P47712 | 1/20 | 0.51 |
| ▸ | FFAR4 | Q5NUL3 | 1/20 | 0.50 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.50 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL65250 | 1.00 | KEAP1 (0.63) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| SCHEMBL29563859 | 1.00 | KEAP1 (0.63) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| Phenyl Propionic Acid SCHEMBL29282176 | 0.96 | KEAP1 (0.70) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| SCHEMBL30825091 | 0.93 | FFAR1 (0.56) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| Sulfuric Acid SCHEMBL18729778 | 0.93 | FFAR1 (0.55) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| SCHEMBL29185406 | 0.93 | FFAR1 (0.56) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| SCHEMBL3717612 | 0.89 | HDAC6 (0.66) | KEAP1FFAR1DRD2DRD1TAAR1 | |
| SCHEMBL70271 | 0.87 | KEAP1 (0.74) | KEAP1FFAR1PTPRBCDC25ACDC25B | |
| SCHEMBL1049248 | 0.87 | HDAC6 (0.67) | DRD2DRD1TAAR1HDAC6 | |
| SCHEMBL30303107 | 0.87 | HDAC6 (0.67) | DRD2DRD1TAAR1HDAC6 |
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-113009122-B | Methods and systems for determining the risk of autism spectrum disorder | 美国控股实验室公司 | 2025-01-17 | — | — | CN | disclosed |