Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of Gluconic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSR | P00390 | 1/20 | 0.54 |
| ▸ | PDE4A | P27815 | 1/20 | 0.51 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 5/20 | 0.39 |
| ▸ | NOS1 | P29475 | 4/20 | 0.39 |
| ▸ | NOS3 | P29474 | 3/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | ARG2 | P78540 | 4/20 | 0.36 |
| ▸ | ARG1 | P05089 | 3/20 | 0.36 |
| ▸ | RNPEP | Q9H4A4 | 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 | |
|---|---|---|---|---|
| Gluconic Acid SCHEMBL27946775 | 0.94 | GSR (0.57) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL16194000 | 0.93 | GSR (0.62) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL16193997 | 0.93 | GSR (0.62) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL28167640 | 0.93 | GSR (0.62) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL28851476 | 0.92 | GSR (0.61) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL17965945 | 0.92 | GSR (0.61) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL6915249 | 0.90 | GSR (0.59) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Gluconic Acid SCHEMBL17965943 | 0.88 | GSR (0.56) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Galactitol SCHEMBL1167727 | 0.87 | GSR (0.71) | GSRPDE4AUSP2SLCO1B1NOS2 | |
| Mannitol SCHEMBL1168590 | 0.87 | GSR (0.71) | GSRPDE4AUSP2SLCO1B1NOS2 |
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-107854457-A | Calcium gluconate Zn composition including chiral photo-isomerisation compound and application thereof | 刘力 | 2018-03-30 | — | — | CN | disclosed |