Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 8/20 | 0.93 |
| ▸ | TLR2 | O60603 | 1/20 | 0.93 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.93 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.93 |
| ▸ | CA12 | O43570 | 1/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | MAPT | P10636 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | RECQL | P46063 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.53 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL16004 | 0.96 | ERN1 (1.00) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL929734 | 0.96 | ERN1 (1.00) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL30485148 | 0.96 | ERN1 (1.00) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL11407272 | 0.94 | ERN1 (0.96) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL4450612 | 0.94 | ERN1 (0.96) | ERN1TLR2TLR1TLR6CA12 | |
| Methylamine SCHEMBL28936774 | 0.93 | ERN1 (0.93) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL28121343 | 0.89 | ERN1 (0.86) | ERN1TLR2TLR1TLR6CA12 | |
| Guaiacol SCHEMBL27774547 | 0.89 | ERN1 (0.78) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL29105898 | 0.88 | ERN1 (0.83) | ERN1TLR2TLR1TLR6CA12 | |
| Ethylenediamine SCHEMBL9276378 | 0.88 | ERN1 (0.83) | ERN1TLR2TLR1TLR6CA12 |
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-106831484-B | O-vanillin bis-ethylenediamine vanadium complex, and synthesis method and application thereof | 河南中医药大学 | 2021-09-21 | — | — | CN | disclosed |