Bicarbonate

Bicarbonate

SCHEMBL27683066

CCc1ccccc1OC.O=C(O)O

nearest known ligand 0.56

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 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 1/20 0.54
MTNR1B P49286 1/20 0.54
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
ALDH1A1 P00352 1/20 0.54
NPC1 O15118 1/20 0.54
RAB9A P51151 1/20 0.54
POLB P06746 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
HTT P42858 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
HPGD P15428 1/20 0.53
TAAR1 Q96RJ0 2/20 0.52
IDO1 P14902 1/20 0.52

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
Propionic Acid SCHEMBL9445395 0.92 POLB (0.55) MTNR1AMTNR1BMEN1KMT2AALDH1A1
SCHEMBL17939 0.91 IDO1 (0.59) MTNR1AMTNR1BALDH1A1HTTL3MBTL1
Methyl Alcohol SCHEMBL11157987 0.89 IDO1 (0.57) MTNR1AMTNR1BALDH1A1SMN1; SMN2HTT
Ammonia Solution, Strong SCHEMBL265951 0.89 IDO1 (0.57) MTNR1AMTNR1BALDH1A1HTTL3MBTL1
SCHEMBL21395 0.88 IDO1 (0.52) MTNR1AMTNR1BALDH1A1SMN1; SMN2HTT
1,2-Dimethoxybenzene SCHEMBL27679751 0.82 CA1 (0.72) KMT2AALDH1A1NPC1RAB9APOLB
SCHEMBL710329 0.82 LMNA (0.56) MTNR1AMTNR1BMEN1KMT2ANPC1
SCHEMBL29431297 0.82 HSD17B10 (0.61) MEN1KMT2ANPC1RAB9APOLB
SCHEMBL155982 0.82 HSD17B10 (0.61) MEN1KMT2ANPC1RAB9APOLB
Bicarbonate SCHEMBL5277147 0.81 IDO1 (0.55) MTNR1AMTNR1BMEN1KMT2AALDH1A1

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-103764689-A Solid catalyst component for polymerization of olefin, catalyst for polymerization of olefin, and method for producing olefin polymer TOHO TITANIUM CO LTD 2014-04-30 CN disclosed
CN-101044109-B Industrial process for production of high-purity diaryl carbonate ASAHI CHEMICAL CORP (JP) 2011-07-06 CN disclosed
CN-101039896-B Process for production of high-purity diaryl carbonate ASAHI CHEMICAL IND (JP) 2011-06-22 CN disclosed
CN-101044109-A Industrial process for production of high-purity diaryl carbonate ASAHI CHEMICAL CORP (JP) 2007-09-26 CN disclosed
CN-101039896-A Process for production of high-purity diaryl carbonate ASAHI CHEMICAL CORP (JP) 2007-09-19 CN disclosed