Bicarbonate

Bicarbonate

SCHEMBL27643185

CCCc1ccc(-c2ccccc2)cc1.O=C(O)O

nearest known ligand 0.62

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 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.62
MCL1 Q07820 1/20 0.57
ABCC4 O15439 1/20 0.55
LMNA P02545 1/20 0.55
GAA P10253 1/20 0.55
TSHR P16473 1/20 0.55
PTGS1 P23219 1/20 0.55
HTT P42858 1/20 0.55
RARB P10826 6/20 0.55
MMP12 P39900 5/20 0.55
SMN1; SMN2 Q16637 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
HPGD P15428 1/20 0.53
MMP13 P45452 4/20 0.53
MAPT P10636 2/20 0.52
MMP2 P08253 1/20 0.51
MMP9 P14780 1/20 0.51
MMP14 P50281 1/20 0.51
MEN1 O00255 1/20 0.51
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL1951510 0.91 FFAR1 (0.54) FFAR1MCL1ABCC4LMNAGAA
Bicarbonate SCHEMBL27623751 0.88 RARB (0.71) FFAR1RARBHPGDMAPTMEN1
Boric Acid SCHEMBL31374401 0.88 LPL (0.55) FFAR1MCL1ABCC4LMNAGAA
SCHEMBL28842020 0.88 FFAR1 (0.52) FFAR1MCL1ABCC4LMNAGAA
Ethyne SCHEMBL28568325 0.87 FFAR1 (0.50) FFAR1MCL1ABCC4LMNAGAA
Bicarbonate SCHEMBL27969158 0.87 ALDH1A1 (0.58) FFAR1SMN1; SMN2L3MBTL1HPGDMAPT
Bicarbonate SCHEMBL27623722 0.86 RARB (0.72) FFAR1RARBHPGDMAPTMEN1
Bicarbonate SCHEMBL27817579 0.85 RARB (0.73) LMNATSHRPTGS1RARBMAPT
Bicarbonate SCHEMBL27643232 0.85 RARB (0.73) LMNATSHRPTGS1RARBMAPT
SCHEMBL17473011 0.84 THRB (0.55) FFAR1MCL1RARBMMP12SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108290820-A Method for recovering aromatic alcohol from melt polymerization and system for recovering same 沙特基础工业全球技术有限公司 2018-07-17 CN disclosed
CN-105189604-B The production of makrolon with limited metal residue 沙特基础全球技术有限公司 2018-02-02 CN disclosed
CN-107075103-A The method that makrolon is manufactured using liquid alcohol/ketone mixtures 沙特基础工业全球技术有限公司 2017-08-18 CN disclosed
CN-104136508-B Prepare for the method with low stress and the film of optical property in photoelectric device 科思创德国股份有限公司 2017-07-21 CN disclosed
CN-105189604-A Production of a polycarbonate with limited metal residuals SABIC INNOVATIVE PLASTICS IP 2015-12-23 CN disclosed
CN-104231254-A Process for the manufacture of polycarbonate compositions SABIC INNOVATIVE PLASTICS IP 2014-12-24 CN disclosed
CN-104136508-A Process for the production of low stress and optical quality film for use in opto-electronic devices BAYER MATERIALSCIENCE AG 2014-11-05 CN disclosed
CN-103748259-A A process for multi-layer continuous roll-to-roll coating BAYER SOUTH EAST ASIA PTE LTD 2014-04-23 CN disclosed
CN-101429277-B Method for producing polycarbonate by the melt transesterification method BAYER MATERIALSCIENCE AG 2013-03-27 CN disclosed
CN-102442910-A Process for preparing diaryl carbonates from dialkyl carbonates BAYER MATERIALSCIENCE AG 2012-05-09 CN disclosed
CN-1712450-B Thermally stable polycarbonate compositions BAYER MATERIALSCIENCE AG 2010-05-26 CN disclosed
CN-101429277-A Method for producing polycarbonate by the melt transesterification method BAYER MATERIALSCIENCE AG (DE) 2009-05-13 CN disclosed
CN-1712450-A Thermally stable polycarbonate compositions BAYER MATERIALSCIENCE AG (DE) 2005-12-28 CN disclosed