Bicarbonate

Bicarbonate

SCHEMBL636595

O=C(O)O.O=C(O)O.O=C(O)O.O=C(O)O.c1cc2cccc3c4cccc5cccc(c(c1)c23)c54

nearest known ligand 0.55

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
CYP1A2 P05177 7/20 0.55
HSD17B10 Q99714 5/20 0.55
ALDH1A1 P00352 5/20 0.55
HPGD P15428 5/20 0.55
THRB P10828 1/20 0.55
NR4A1 P22736 1/20 0.50
NR4A2 P43354 1/20 0.50
NR4A3 Q92570 1/20 0.50
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
KDM4E B2RXH2 5/20 0.46
GLA P06280 2/20 0.46
CYP2D6 P10635 2/20 0.46
POLB P06746 1/20 0.46
CYP3A4 P08684 2/20 0.45
TSHR P16473 2/20 0.45
CYP1A1 P04798 1/20 0.45
CYP1B1 Q16678 1/20 0.45
TDP1 Q9NUW8 4/20 0.45
CYP2C19 P33261 2/20 0.44

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 SCHEMBL2585744 1.00 CYP1A2 (0.55) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Bicarbonate SCHEMBL3836308 1.00 CYP1A2 (0.55) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Carbamic Acid SCHEMBL15123720 0.90 ALDH1A1 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Carbamic Acid SCHEMBL2581160 0.90 ALDH1A1 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Acetic Acid SCHEMBL28706282 0.90 ALDH1A1 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Carbamic Acid SCHEMBL9232567 0.90 ALDH1A1 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL636521 0.90 CYP1A2 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Acetic Acid SCHEMBL28736368 0.90 ALDH1A1 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
SCHEMBL4628576 0.90 CYP1A2 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB
Acetic Acid SCHEMBL29538855 0.90 ALDH1A1 (0.50) CYP1A2HSD17B10ALDH1A1HPGDTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2462203-B1 ELECTRONIC DEVICES COMPRISING MULTI CYCLIC HYDROCARBONS MERCK PATENT GMBH (DE) 2016-03-02 EP claimed
EP-1128192-B1 DICHROIC POLARISER AND METHOD FOR MAKING THE SAME NITTO DENKO CORP (JP) 2010-01-06 EP claimed
EP-1989038-B1 METHOD FOR PROVIDING A POLARIZING LAYER ON AN OPTICAL ELEMENT ESSILOR CIE GENERALE D OPTIQUE (FR) 2009-12-30 EP claimed
US-20090187234-A1 COLORED AND WHITE LIGHT GENERATING LIGHTING DEVICE KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) 2009-07-23 US claimed
US-20090091945-A1 Coloured Polyurethane Light Guides POLY OPTICS AUSTRALIA PTY LTD. (AU) 2009-04-09 US claimed
EP-1796189-B1 Electrode materials having high surface conductivity HYDRO QUEBEC (CA) 2009-03-25 EP claimed
EP-2038577-A1 COLORED AND WHITE LIGHT GENERATING LIGHTING DEVICE Philips Intellectual Property & Standards GmbH (DE) 2009-03-25 EP claimed
EP-1924872-A1 COLOURED POLYURETHANE LIGHT GUIDES Poly Optics Australia PTY. Ltd. (AU) 2008-05-28 EP claimed
EP-1049182-B1 Electrode materials having increased surface conductivity HYDRO QUEBEC (CA) 2008-01-02 EP claimed
WO-2007141688-A1 COLORED AND WHITE LIGHT GENERATING LIGHTING DEVICE PHILIPS INTELLECTUAL PROPERTY & STANDARDS GMBH (DE) 2007-12-13 WO claimed
EP-0829496-A1 Pigment preparations BAYER AG (DE) 1998-03-18 EP claimed
EP-0735109-A2 Aqueous pigment preparations BAYER AG (DE) 1996-10-02 EP claimed
EP-0698649-A1 Use of thermoplastically processible long time stable electroluminescent materials BASF AKTIENGESELLSCHAFT (DE) 1996-02-28 EP claimed
EP-0403917-B1 Solid pigment preparations of high concentration BASF AG (DE) 1994-02-16 EP claimed
EP-0403917-A1 Solid pigment preparations of high concentration BASF Aktiengesellschaft (DE) 1990-12-27 EP claimed
EP-0255078-A2 Aqueous pigment preparations and their use HOECHST AKTIENGESELLSCHAFT (DE) 1988-02-03 EP claimed
EP-0075182-B1 CONDITIONING PROCESS OF AN ORGANIC PIGMENT Mobay Chemical Corporation (US) 1985-12-11 EP claimed
EP-0069895-B1 PROCESS FOR CONDITIONING A PIGMENT Mobay Chemical Corporation (US) 1984-10-10 EP claimed
EP-0075182-A1 Conditioning process of an organic pigment Mobay Chemical Corporation (US) 1983-03-30 EP claimed
EP-0069895-A2 Process for conditioning a pigment Mobay Chemical Corporation (US) 1983-01-19 EP claimed