Bicarbonate

Bicarbonate

SCHEMBL1031673

CC(C)(c1ccccc1)c1ccc(O)cc1.O=C(O)O

nearest known ligand 0.87

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
ESR1 P03372 5/20 0.87
ESR2 Q92731 5/20 0.87
ALDH1A1 P00352 4/20 0.87
CYP3A4 P08684 3/20 0.87
AR P10275 1/20 0.70
HPGD P15428 1/20 0.70
TSHR P16473 1/20 0.70
SLC6A2 P23975 1/20 0.70
SLC6A4 P31645 1/20 0.70
HTR6 P50406 1/20 0.70
ESRRG P62508 1/20 0.70
SLC6A3 Q01959 1/20 0.70
HSD17B10 Q99714 1/20 0.70
LMNA P02545 1/20 0.50
TYR P14679 1/20 0.50
NR3C2 P08235 3/20 0.47
KMT2A Q03164 2/20 0.47
MAPT P10636 1/20 0.47
CHRM2 P08172 1/20 0.45
CHRM4 P08173 1/20 0.45

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 SCHEMBL21681661 1.00 ESR1 (0.87) ESR1ESR2ALDH1A1CYP3A4AR
Bicarbonate SCHEMBL23683863 1.00 ESR1 (0.87) ESR1ESR2ALDH1A1CYP3A4AR
Bisphenol A SCHEMBL4809570 0.96 ESR1 (0.79) ESR1ESR2ALDH1A1CYP3A4AR
SCHEMBL9353524 0.93 ESR1 (1.00) ESR1ESR2ALDH1A1CYP3A4AR
Bisphenol A SCHEMBL1940373 0.93 ESR1 (0.80) ESR1ESR2ALDH1A1CYP3A4AR
SCHEMBL51117 0.93 ESR1 (1.00) ESR1ESR2ALDH1A1CYP3A4AR
Bisphenol A SCHEMBL23414108 0.93 ESR1 (0.80) ESR1ESR2ALDH1A1CYP3A4AR
SCHEMBL4310025 0.93 ESR1 (1.00) ESR1ESR2ALDH1A1CYP3A4AR
SCHEMBL28822358 0.92 ESR1 (0.80) ESR1ESR2ALDH1A1CYP3A4AR
SCHEMBL10953906 0.92 ESR1 (0.80) ESR1ESR2ALDH1A1CYP3A4AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1360221-B1 MELT POLYCARBONATE CATALYST SYSTEMS GEN ELECTRIC (US) 2007-12-12 EP claimed
EP-1358246-B1 MELT POLYCARBONATE CATALYST SYSTEMS GEN ELECTRIC (US) 2006-07-12 EP claimed
EP-1358247-B1 MELT POLYCARBONATE CATALYST SYSTEMS GEN ELECTRIC (US) 2006-06-21 EP claimed
EP-1399498-B1 MELT POLYCARBONATE CATALYST SYSTEMS GEN ELECTRIC (US) 2006-06-21 EP claimed
EP-1353971-B1 MELT POLYCARBONATE CATALYST SYSTEMS GEN ELECTRIC (US) 2005-05-11 EP claimed
EP-1360221-A1 MELT POLYCARBONATE CATALYST SYSTEMS GENERAL ELECTRIC COMPANY (US) 2003-11-12 EP claimed
EP-1358246-A2 MELT POLYCARBONATE CATALYST SYSTEMS GENERAL ELECTRIC COMPANY (US) 2003-11-05 EP claimed
EP-1358247-A2 MELT POLYCARBONATE CATALYST SYSTEMS GENERAL ELECTRIC COMPANY (US) 2003-11-05 EP claimed
WO-2002055585-A2 MELT POLYCARBONATE CATALYST SYSTEMS GEN ELECTRIC (US) 2002-07-18 WO claimed
WO-2002055583-A2 MELT POLYCARBONATE CATALYST SYSTEMS GENERAL ELECTRIC COMPANY (US) 2002-07-18 WO claimed
WO-2002055584-A1 MELT POLYCARBONATE CATALYST SYSTEMS GENERAL ELECTRIC COMPANY (US) 2002-07-18 WO claimed
US-6395862-B1 CONTACTING DIARYLOXY COMPOUND WITH DIHYDRIC PHENOL IN THE PRESENCE OF ALKALI METAL TRIAZINE PYRIDYL SULFONATE, CARBOXY OR PHOSPHONATE GENERAL ELECTRIC COMPANY 2002-05-28 US claimed
US-6376640-B1 USING CESIUM POLYMERIZATION CATALYST GENERAL ELECTRIC COMPANY 2002-04-23 US claimed
US-6323304-B1 CONTACTING A DIARYLOXY COMPOUND WITH A DIHYDRIC PHENOL COMPOUND IN THE PRESENCE OF CATALYST COMPRISED OF ALKALI OR ALKALINE EARTH METAL-TRANSITION METAL FLUORIDE COMPOUND AND IN PRESENCE OF COCATALYST GENERAL ELECTRIC COMPANY 2001-11-27 US claimed
US-6323303-B1 POLYMERIZING DIARYLOXY COMPOUND WITH A DIHYDRIC PHENOL COMPOUND IN THE PRESENCE OF A RUTHENIUM (II) OR RUTHENIUM (III) COMPOUND OR COMPLEX; OPTIONALLY IN PRESENCE OF A TETRAALKYL AMMONIUM OR TETRAALKYL PHOSPHONIUM SALT GENERAL ELECTRIC COMPANY 2001-11-27 US claimed
US-6303737-B1 POLYCONDENSATION CATALYSTS WHICH ARE SALTS OF CERTAIN PHENANTHROLINE COMPOUNDS; EXCELLENT POLYMERIZATION RATES; REDUCING THE LEVEL OF BRANCHING SIDE REACTION, I.E., FORMATION OF FRIES PRODUCT GENERAL ELECTRIC COMPANY 2001-10-16 US claimed
US-6291631-B1 CONTACTING DIARYLOXY COMPOUND WITH A DIHYDRIC PHENOL COMPOUND IN THE POLYMERIZATION CATALYST UNDER POLYCARBONATE MELT POLYMERIZATION CONDITIONS GENERAL ELECTRIC COMPANY 2001-09-18 US claimed
EP-2561004-A1 POLYCARBONATE COPOLYMER Styron Europe GmbH (CH) 2013-02-27 EP disclosed
US-6184334-B1 HEATING, IN ONE OR MORE STAGES, MIXTURE COMPRISING DIPHENOL AND DIARYLCARBONATE; INTRODUCING IN SAME STAGE OR DIFFERENT STAGES ALKALI METAL SALTS OF OXOACIDS OF SULFUR AS POLYMERIZATION CATALYST GENERAL ELECTRIC COMPANY 2001-02-06 US disclosed
US-6184335-B1 HEATING, IN ONE OR MORE STAGES, MIXTURE COMPRISING DIPHENOL AND DIARYLCARBONATE; IN THE SAME STAGE OR DIFFERENT STAGES INTRODUCING CATALYTICALLY EFFECTIVE AMOUNT OF AN ALKALI AND/OR ALKALI EARTH METAL SALT OF ARYL SULFONIC ACID GENERAL ELECTRIC COMPANY 2001-02-06 US disclosed