Bicarbonate

Bicarbonate

SCHEMBL7996596

O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.O=C([O-])O.O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].O=C([O-])[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]

nearest known ligand 0.50

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 16)

geneUniProtsupporting neighboursconfidence
CA4 P22748 6/20 0.50
CA1 P00915 3/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 1/20 0.50
FAHD1 Q6P587 1/20 0.50
MEN1 O00255 1/20 0.40
LDHA P00338 1/20 0.40
BLM P54132 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 2/20 0.38
CASP1 P29466 1/20 0.38
FFAR3 O14843 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC8 Q9BY41 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 SCHEMBL9436976 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL7983250 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL7527293 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL9004283 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL15103409 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL10379498 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL9001699 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL8009950 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL9013971 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1
Bicarbonate SCHEMBL9437102 1.00 CA4 (0.50) CA4CA1CA2CA9FAHD1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6281276-B1 POLYVINYL CHLORIDE THE DOW CHEMICAL COMPANY 2001-08-28 US disclosed
US-6114428-A COMPRISING SMELT OF PARTICLE SIZE OF 0.0005MM AS A FILLER, FOAMING AGENT AND OR STABILIZER; SMELT IS A BY-PRODUCT OF THE PULP AND PAPER INDUCTRY AND COMPRISES INORGANIC SALTS OF SODIUM; POLLUTION CONTROL MORTILE INDUSTRIES LTD. (CA) 2000-09-05 US disclosed
EP-0970146-A1 COMPOSITIONS OF THERMOPLASTIC POLYMER AND SMELT THE DOW CHEMICAL COMPANY (US) 2000-01-12 EP disclosed
WO-1998042779-A1 COMPOSITIONS OF THERMOPLASTIC POLYMER AND SMELT THE DOW CHEMICAL COMPANY (US) 1998-10-01 WO disclosed