Bicarbonate

Bicarbonate

SCHEMBL28617859

O=C(O)O.O=C1CCCC(=O)N1.O=C1CCCC(=O)N1

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Bicarbonate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 10/20 0.77
MAPT P10636 1/20 0.41
OR51E2 Q9H255 1/20 0.39
ALDH1A1 P00352 1/20 0.38
FKBP5 Q13451 1/20 0.38
ITGB3 P05106 1/20 0.37
ITGB1 P05556 1/20 0.37
ITGAV P06756 1/20 0.37
ITGA4 P13612 1/20 0.37
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
CYP2C19 P33261 1/20 0.36
RAB9A P51151 1/20 0.36
KMT2A Q03164 1/20 0.36
DDB1 Q16531 4/20 0.35
ABL1 P00519 1/20 0.32
RIN1 Q13671 1/20 0.32

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.

Compoundsimilaritytop predictedshared targets
Bicarbonate SCHEMBL28617862 1.00 CRBN (0.77) CRBNMAPTOR51E2ALDH1A1FKBP5
Oxalic Acid SCHEMBL30524294 0.92 CRBN (0.72) CRBNMAPTOR51E2ALDH1A1FKBP5
Acetic Acid SCHEMBL28337387 0.89 CRBN (0.68) CRBNMAPTOR51E2ALDH1A1FKBP5
Succinimide SCHEMBL6036901 0.88 CRBN (0.73) CRBNMAPTALDH1A1ITGB3ITGB1
Succinimide SCHEMBL434236 0.88 CRBN (0.73) CRBNMAPTALDH1A1ITGB3ITGB1
Succinimide SCHEMBL6717091 0.88 CRBN (0.73) CRBNMAPTALDH1A1ITGB3ITGB1
SCHEMBL26618 0.87
SCHEMBL5778743 0.87 CRBN (1.00) CRBNMAPTOR51E2ALDH1A1FKBP5
Methyl Alcohol SCHEMBL28109851 0.85 CRBN (0.81) CRBNMAPTOR51E2ALDH1A1FKBP5
Benzene SCHEMBL27901053 0.85 CRBN (0.81) CRBNMAPTOR51E2ALDH1A1FKBP5

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113195699-A Detergent composition and washing method using same 凯斯科技股份有限公司 2021-07-30 CN claimed