Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.45 |
| ▸ | SLC6A3 | Q01959 | 3/20 | 0.45 |
| ▸ | DRD3 | P35462 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.45 |
| ▸ | EDNRB | P24530 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | MC4R | P32245 | 1/20 | 0.45 |
| ▸ | MC3R | P41968 | 1/20 | 0.45 |
| ▸ | DRD2 | P14416 | 1/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL6402185 | 0.91 | SLC6A3 (0.52) | ALDH1A1CYP2C19SLC6A3DRD3LMNA | |
| Acetamide SCHEMBL27959240 | 0.86 | CYP2C19 (0.47) | ALDH1A1CYP2C19SLC6A3DRD3LMNA | |
| SCHEMBL3355942 | 0.75 | CYP2D6 (0.44) | ALDH1A1CYP2C19SLC6A3DRD3LMNA | |
| SCHEMBL1131704 | 0.75 | GABBR2 (0.53) | CYP2C19LMNAMAPK1CYP2D6MAPT | |
| SCHEMBL9491712 | 0.74 | LMNA (0.43) | ALDH1A1CYP2C19SLC6A3DRD3LMNA | |
| SCHEMBL7765052 | 0.73 | CYP2C19 (0.43) | ALDH1A1CYP2C19SLC6A3DRD3LMNA | |
| SCHEMBL1383474 | 0.73 | CYP2C19 (0.67) | ALDH1A1CYP2C19SLC6A3DRD3LMNA | |
| SCHEMBL6404252 | 0.73 | CYP2D6 (0.46) | ALOX15CYP2C19SLC6A3DRD3LMNA | |
| Phthalic Acid SCHEMBL30137691 | 0.72 | ALDH1A1 (0.82) | ALDH1A1ALOX15KDM4EHTTSMN1; SMN2 | |
| Phthalic Acid SCHEMBL29276287 | 0.72 | ALDH1A1 (0.82) | ALDH1A1ALOX15KDM4EHTTSMN1; SMN2 |
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-115677821-A | Antibacterial peptide and preparation method thereof | 韩玉玲 | 2023-02-03 | — | — | CN | disclosed |