Bicarbonate

Bicarbonate

SCHEMBL8981886

O=C(O)C1CCCCC1C(=O)OC(=O)C1CCCCC1C(=O)O.O=C(O)O.O=C(O)O

nearest known ligand 0.59

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 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
PEPD P12955 1/20 0.42
TP53 P04637 1/20 0.39
CYP3A4 P08684 1/20 0.39
MEN1 O00255 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
GRM4 Q14833 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HTT P42858 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL34169 0.98 PEPD (0.43) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL130870 0.98 PEPD (0.43) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL598373 0.98 PEPD (0.43) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL10578737 0.98 PEPD (0.43) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL10739888 0.95 PEPD (0.42) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL9663237 0.95 PEPD (0.42) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL7031195 0.95 PEPD (0.42) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL11660179 0.95 PEPD (0.42) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL5525138 0.93 PEPD (0.48) ALDH1A1LMNAPEPDTP53CYP3A4
SCHEMBL336245 0.93 PEPD (0.48) ALDH1A1LMNAPEPDTP53CYP3A4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0394192-B1 Curable mixture based on cycloaliphatic epoxy resins CIBA GEIGY AG (CH) 1996-05-29 EP claimed
EP-0394192-A2 Curable mixture based on cycloaliphatic epoxy resins CIBA-GEIGY AG (CH) 1990-10-24 EP claimed