Known targets — ChEMBL curated mechanism
KCNA1KCNA10KCNA2KCNA3KCNA4KCNA5KCNA6KCNA7KCNB1KCNB2KCNC1KCNC2KCNC3KCNC4KCND1KCND2KCND3KCNF1KCNG1KCNG2KCNG3KCNG4KCNH1KCNH2KCNH3KCNH4KCNH5KCNH6KCNH7KCNH8KCNQ1KCNQ2KCNQ3KCNQ4KCNQ5KCNS1KCNS2KCNS3KCNV1KCNV2
The experimentally established mechanism targets of Glutaral. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HIF1A | Q16665 | 1/20 | 0.62 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TRPV1 | Q8NER1 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| Glutaral SCHEMBL8758361 | 0.84 | HIF1A (0.67) | HIF1ATSHRTRPV1MAPTFAAH | |
| Biguanide SCHEMBL28148706 | 0.84 | HIF1A (0.50) | HIF1ATSHRTRPV1MAPTFAAH | |
| Glutaral SCHEMBL9577814 | 0.81 | HIF1A (0.62) | HIF1ATSHRTRPV1MAPTFAAH | |
| SCHEMBL1345103 | 0.80 | — | — | |
| Glutaral SCHEMBL9507894 | 0.79 | — | — | |
| Glutaral SCHEMBL5868481 | 0.79 | — | — | |
| Glutaral SCHEMBL836 | 0.79 | — | — | |
| Glutaral SCHEMBL1285455 | 0.79 | HIF1A (1.00) | HIF1ATSHRTRPV1MAPTFAAH | |
| Glutaral SCHEMBL1259856 | 0.79 | HIF1A (0.59) | HIF1ATSHRTRPV1MAPTFAAH | |
| Butanal SCHEMBL28549595 | 0.77 | — | — |
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-107751230-A | Water injection well bactericide and preparation method and application thereof | 中国石油天然气股份有限公司 | 2018-03-06 | — | — | CN | disclosed |