Bicarbonate

Bicarbonate

SCHEMBL28326314

O=C(O)O.OCCCCCCCCCCO

nearest known ligand 0.65

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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 20)

geneUniProtsupporting neighboursconfidence
GPR84 Q9NQS5 1/20 0.65
FFAR1 O14842 1/20 0.65
FFAR4 Q5NUL3 1/20 0.65
CAMK2A Q9UQM7 1/20 0.53
LMNA P02545 4/20 0.47
TSHR P16473 3/20 0.47
ALDH1A1 P00352 2/20 0.47
HSD17B10 Q99714 1/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
SMN1; SMN2 Q16637 2/20 0.43
KDM4E B2RXH2 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA9 Q16790 1/20 0.42
NFKB1 P19838 1/20 0.41
PMP22 Q01453 1/20 0.41
GAA P10253 1/20 0.36

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 SCHEMBL28327101 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,6-Hexanediol SCHEMBL29109662 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,6-Hexanediol SCHEMBL28737103 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,6-Hexanediol SCHEMBL28984424 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,5-Pentanediol SCHEMBL575113 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
Bicarbonate SCHEMBL28380298 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,5-Pentanediol SCHEMBL29150346 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,6-Hexanediol SCHEMBL628080 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
1,6-Hexanediol SCHEMBL6707356 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA
Bicarbonate SCHEMBL28191659 1.00 GPR84 (0.65) GPR84FFAR1FFAR4CAMK2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113956505-B Polylactic acid emulsion, and preparation method and application thereof 海南赛诺实业有限公司 2023-05-16 CN claimed
CN-110407991-B Multi-block copolymer based on 2, 5-furandicarboxylic acid polyester and aliphatic polycarbonate and preparation method thereof 浙江大学 2020-07-17 CN claimed
CN-110407991-A A kind of segmented copolymer and preparation method thereof based on 2,5- furandicarboxylic acid polyester and fatty poly-ester carbonate UNIV ZHEJIANG 2019-11-05 CN claimed
CN-113956505-B Polylactic acid emulsion, and preparation method and application thereof 海南赛诺实业有限公司 2023-05-16 CN disclosed
CN-110407991-B Multi-block copolymer based on 2, 5-furandicarboxylic acid polyester and aliphatic polycarbonate and preparation method thereof 浙江大学 2020-07-17 CN disclosed