Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 6/20 | 0.69 |
| ▸ | TLR2 | O60603 | 1/20 | 0.69 |
| ▸ | TLR1 | Q15399 | 1/20 | 0.69 |
| ▸ | TLR6 | Q9Y2C9 | 1/20 | 0.69 |
| ▸ | CA12 | O43570 | 1/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | SRC | P12931 | 1/20 | 0.43 |
| ▸ | BACE1 | P56817 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL10428272 | 0.89 | ERN1 (0.73) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL28657557 | 0.86 | ERN1 (0.73) | ERN1TLR2TLR1TLR6CA12 | |
| Ethylenediamine SCHEMBL9276378 | 0.85 | ERN1 (0.83) | ERN1TLR2TLR1TLR6CA12 | |
| Ethylenediamine SCHEMBL28296472 | 0.85 | ERN1 (0.83) | ERN1TLR2TLR1TLR6CA12 | |
| Ethylenediamine SCHEMBL28149520 | 0.84 | ERN1 (0.81) | ERN1TLR2TLR1TLR6CA12 | |
| Ethylenediamine SCHEMBL28650216 | 0.84 | ERN1 (0.81) | ERN1TLR2TLR1TLR6CA12 | |
| Methylamine SCHEMBL28936774 | 0.83 | ERN1 (0.93) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL16004 | 0.83 | ERN1 (1.00) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL30485148 | 0.83 | ERN1 (1.00) | ERN1TLR2TLR1TLR6CA12 | |
| SCHEMBL929734 | 0.83 | ERN1 (1.00) | 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-105153242-A | Multifunctional metal organic complex and preparation method therefor | UNIV GUANGXI NORMAL | 2015-12-16 | — | — | CN | disclosed |