Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 1/20 | 0.42 |
| ▸ | PLG | P00747 | 1/20 | 0.42 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.42 |
| ▸ | TNKS | O95271 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.41 |
| ▸ | NOS3 | P29474 | 1/20 | 0.41 |
| ▸ | NOS1 | P29475 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 1/20 | 0.41 |
| ▸ | DHODH | Q02127 | 6/20 | 0.39 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.38 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.37 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.36 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 1/20 | 0.36 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.36 |
| ▸ | BACE1 | P56817 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 2/20 | 0.35 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29935491 | 0.79 | L3MBTL1 (0.54) | HTTCTDSP1BACE1 | |
| SCHEMBL29935493 | 0.79 | L3MBTL1 (0.42) | F2PLGPRSS1TNKSTNKS2 | |
| SCHEMBL22534233 | 0.79 | L3MBTL1 (0.42) | F2PLGPRSS1TNKSTNKS2 | |
| Formaldehyde SCHEMBL28856614 | 0.76 | LMNA (0.50) | LTB4RHTTCTDSP1BACE1 | |
| SCHEMBL22545468 | 0.73 | NOS1 (0.66) | TNKSTNKS2NOS3NOS1NOS2 | |
| SCHEMBL22534222 | 0.67 | CYP11B1 (0.37) | BACE1 | |
| SCHEMBL22545314 | 0.65 | F2 (0.43) | F2PLGPRSS1TNKSTNKS2 | |
| SCHEMBL27388542 | 0.64 | TNKS (0.53) | TNKSTNKS2MAP4K4ALOX5APFEN1 | |
| SCHEMBL2744804 | 0.63 | MEN1 (0.49) | NOS2BACE1 | |
| SCHEMBL13788341 | 0.62 | PIK3R1 (0.50) | DHODHMAP4K4ALOX5APFEN1BACE1 |
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-111793025-B | Method for modifying amino in molecule by oxazoline quaternary ammonium salt and application thereof | 中国科学院上海药物研究所 | 2022-09-23 | — | — | CN | disclosed |