Bicarbonate

Bicarbonate

SCHEMBL9016429

O=C(O)O.OC(O)C(c1ccccc1)c1ccccc1

nearest known ligand 0.54

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
LMNA P02545 4/20 0.54
MAPK1 P28482 1/20 0.54
SRC P12931 2/20 0.50
CYP2D6 P10635 1/20 0.50
CES2 O00748 2/20 0.48
CES1 P23141 2/20 0.48
TDP1 Q9NUW8 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
HPGD P15428 1/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43

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
SCHEMBL4348933 0.92 LMNA (0.48) LMNAMAPK1SRCCYP2D6L3MBTL1
Anthracene SCHEMBL28466109 0.80 UGT2B7 (0.43) LMNAMAPK1CYP2D6
Diphenylmethanol SCHEMBL9188301 0.78 LMNA (0.59) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL8109262 0.77 LMNA (0.58) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL28735249 0.77 LMNA (0.52) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL8579904 0.76 LMNA (0.44) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL1742565 0.76 SRC (0.59) LMNAMAPK1SRCCYP2D6CES2
Bicarbonate SCHEMBL7286375 0.75 HDAC1 (0.58) LMNAMAPK1SRCCYP2D6CES2
SCHEMBL6573477 0.74 LMNA (0.42) LMNAMAPK1L3MBTL1
Phenyl Ethanol SCHEMBL28552574 0.74 LMNA (0.54) LMNAMAPK1SRCCYP2D6CES2

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5585177-A FLAVOR RETENTION; FOOD AND BEVERAGE PACKAGING TOYO KOHAN CO., LTD. (JP) 1996-12-17 US disclosed
EP-0209393-B1 DEEP-DRAW-FORMED VESSEL AND PROCESS FOR PREPARATION THEREOF TOYO SEIKAN KAISHA LIMITED (JP) 1991-05-02 EP disclosed
US-4858782-A Metal vessel having circumferential side seam and process for production thereof TOYO SEIKAN KAISHA, LTD. (JP) 1989-08-22 US disclosed
EP-0182646-B1 PACKAGING MATERIAL COMPRISING IRON FOIL, AND CONTAINER AND CONTAINER LID COMPOSED THEREOF TOYO SEIKAN KAISHA LIMITED (JP) 1989-03-15 EP disclosed
US-4734303-A METAL FOIL, PLASTIC FILM TOYO SEIKAN KAISHA, LTD. (JP) 1988-03-29 US disclosed
US-4686152-A THERMOPLASTIC RESIN LAMINATE TOYO SEIKAN KAISHA, LTD. (JP) 1987-08-11 US disclosed
EP-0209393-A2 Deep-draw-formed vessel and process for preparation thereof TOYO SEIKAN KAISHA LIMITED (JP) 1987-01-21 EP disclosed
EP-0182646-A2 Packaging material comprising iron foil, and container and container lid composed thereof TOYO SEIKAN KAISHA LIMITED (JP) 1986-05-28 EP disclosed
EP-0078625-B1 EASILY-OPENABLE HEAT SEAL LID TOYO SEIKAN KAISHA LIMITED (JP) 1986-03-05 EP disclosed
EP-0079136-B1 PROCESS FOR PREPARATION OF METAL VESSELS TOYO SEIKAN KAISHA LIMITED (JP) 1986-01-29 EP disclosed
US-4428494-A Easily-openable heat seal lid TOYO SEIKAN KAISHA, LTD. (JP) 1984-01-31 US disclosed
US-4403710-A Easily-openable heat seal lid TOYO SEIKAN KAISHA LTD. (JP) 1983-09-13 US disclosed
EP-0079136-A1 Process for preparation of metal vessels TOYO SEIKAN KAISHA LIMITED (JP) 1983-05-18 EP disclosed
EP-0078625-A1 Easily-openable heat seal lid TOYO SEIKAN KAISHA LIMITED (JP) 1983-05-11 EP disclosed
US-4382525-A THERMOSETTING AND THERMOPLASTIC RESINS TOYO SEIKAN KAISHA, LTD. (JP) 1983-05-10 US disclosed
EP-0076634-A1 Process for preparation of metallic bottles TOYO SEIKAN KAISHA LIMITED (JP) 1983-04-13 EP disclosed
EP-0075427-A2 Metal vessel having circumferential side seam and process for production thereof TOYO SEIKAN KAISHA LIMITED (JP) 1983-03-30 EP disclosed
EP-0065417-A2 Easily-openable heat seal lid TOYO SEIKAN KAISHA LIMITED (JP) 1982-11-24 EP disclosed
US-3975463-A Molded structures containing crystalling polyolefin saponified ethylene vinyl acetate copolymer and carbonyl containing copolymers TOYO SEIKAN KAISHA LIMITED (JA) 1976-08-17 US disclosed
US-3932692-A Resinious laminates having improved gas permeation and delamination resistance TOYO SEIKAN KAISHA LIMITED (JA) 1976-01-13 US disclosed