Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | WDR5 | P61964 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | CTDSP1 | Q9GZU7 | 1/20 | 0.37 |
| ▸ | MMP3 | P08254 | 1/20 | 0.37 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | GSK3B | P49841 | 1/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 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 | |
|---|---|---|---|---|
| SCHEMBL25387866 | 0.88 | PTGS2 (0.35) | SMN1; SMN2MAPTATMLMNACYP1A2 | |
| SCHEMBL28496291 | 0.76 | CES2 (0.38) | GSK3BHDAC1HDAC2LMNA | |
| SCHEMBL28278597 | 0.76 | CES2 (0.38) | SMN1; SMN2RAB9ANPC1BCL2L1PTPN1 | |
| SCHEMBL26817863 | 0.76 | ALDH1A1 (0.38) | SMN1; SMN2MAPTRAB9ANPC1GSK3B | |
| SCHEMBL28309582 | 0.76 | CES2 (0.38) | L3MBTL1GSK3BATMLMNAALDH1A1 | |
| SCHEMBL28526969 | 0.74 | CES2 (0.46) | SMN1; SMN2MAPTRAB9ANPC1PTPN1 | |
| SCHEMBL28199752 | 0.74 | BCAT2 (0.43) | SMN1; SMN2BCL2L1LMNAALDH1A1HPGD | |
| SCHEMBL22041096 | 0.74 | WDR5 (0.48) | SMN1; SMN2MAPTWDR5RAB9ANPC1 | |
| SCHEMBL28410993 | 0.72 | ALDH1A1 (0.44) | RAB9AKDM4EALDH1A1EGFR | |
| SCHEMBL28497997 | 0.72 | MAPT (0.46) | SMN1; SMN2MAPTLMNAHIF1AKDM4E |
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-110204481-B | Polysubstituted nitrogen-containing aromatic heterocyclic compound and preparation method and application thereof | 中国农业大学 | 2021-01-19 | — | — | CN | disclosed |