Bicarbonate

Bicarbonate

SCHEMBL366336

C1CCC(OOC2CCCCC2)CC1.O=C(O)O.O=C(O)O

nearest known ligand 0.43

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
EPHX1 P07099 7/20 0.43
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CYP2C19 P33261 1/20 0.38
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
NAAA Q02083 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
MAPT P10636 1/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CYP3A4 P08684 1/20 0.36
EPHX2 P34913 1/20 0.36
HTT P42858 1/20 0.35
FABP7 O15540 1/20 0.35
FABP5 Q01469 1/20 0.35

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 SCHEMBL28775658 1.00 EPHX1 (0.43) EPHX1CES2CES1CA1CA2
Bicarbonate SCHEMBL6566447 1.00 EPHX1 (0.43) EPHX1CES2CES1CA1CA2
SCHEMBL909903 0.87 EPHX1 (0.39) EPHX1CES2CES1CA1CA2
SCHEMBL36848 0.84 CA1 (0.41) EPHX1CES2CES1CA1CA2
SCHEMBL28573115 0.84 CA1 (0.41) EPHX1CES2CES1CA1CA2
SCHEMBL11679637 0.84 CA1 (0.41) EPHX1CES2CES1CA1CA2
SCHEMBL11638037 0.84 CA1 (0.41) EPHX1CES2CES1CA1CA2
SCHEMBL6507671 0.81 EPHX1 (0.39) EPHX1CES2CES1CA1CA2
SCHEMBL7015517 0.81 EPHX1 (0.43) EPHX1CES2CES1CA1CA2
SCHEMBL15157468 0.81 CA1 (0.39) EPHX1CA1CA2CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109762117-A The synthetic method of polyether polyol 山东蓝星东大有限公司 2019-05-17 CN claimed
CN-108634477-A A kind of manufacturing method of internal height-increasing shoe 广州市鸿峥实业有限公司 2018-10-12 CN claimed
EP-3652245-B1 ADDITIVE MIXTURES FOR PLASTICS, LASER-MARKABLE POLYMER COMPOSITIONS CONTAINING SAME, AND USE THEREOF CLARIANT INT LTD (CH) 2024-04-24 EP disclosed
US-11945913-B2 Thermosetting polyimide resin and manufacturing method thereof, composition, prepolymer, film, adhesive, and use thereof CHIN YEE CHEMICAL INDUSTRIES CO., LTD. (TW) 2024-04-02 US disclosed
EP-3652241-B1 ADDITIVE MIXTURES FOR PLASTICS, LASER-MARKABLE POLYMER COMPOSITIONS CONTAINING SAME AND USE THEREOF CLARIANT INT LTD (CH) 2023-04-19 EP disclosed
CN-115894804-A Copolymer containing PVDF unit, preparation method thereof, humidity-sensitive film and application of humidity-sensitive film 广州奥松电子股份有限公司 2023-04-04 CN disclosed
CN-115286767-A Antibacterial fluorine modified epoxy vinyl ester resin, preparation method thereof and multi-mechanism synergetic universal anticorrosive coating 海洋化工研究院有限公司 2022-11-04 CN disclosed
WO-2020186482-A1 POLYMER AND PREPARATION METHOD AND APPLICATION THEREOF 深圳大学 2020-09-24 WO disclosed
CN-107556433-B Dynamic polymer elastomer with hybrid cross-linked network and application thereof 翁秋梅 2020-07-31 CN disclosed
EP-3679094-A1 FLAME RETARDANT COMBINATIONS FOR POLYMER COMPOSITIONS AND USE THEREOF Clariant Plastics & Coatings Ltd (CH) 2020-07-15 EP disclosed
EP-3679095-A1 SYNERGISTIC FLAME RETARDANT COMBINATIONS FOR POLYMER COMPOSITIONS AND USE THEREOF Clariant Plastics & Coatings Ltd (CH) 2020-07-15 EP disclosed
EP-0815839-A2 Cosmetic or pharmaceutical composition containing an acrylic polymer BASF AKTIENGESELLSCHAFT (DE) 1998-01-07 EP disclosed
EP-0780401-A1 Process for preparing polymers by emulsion polymerization BASF AKTIENGESELLSCHAFT (DE) 1997-06-25 EP disclosed
EP-0666878-B1 NEW POLYMERS BASED ON POLYARYLENE SILOXANES AND RADICALLY POLYMERISABLE MONOMERS HOECHST AG (DE) 1997-01-22 EP disclosed
EP-0666878-A1 NEW POLYMERS BASED ON POLYARYLENE SILOXANES AND RADICALLY POLYMERISABLE MONOMERS. HOECHST AG (DE) 1995-08-16 EP disclosed
WO-1994010218-A1 NEW POLYMERS BASED ON POLYARYLENE SILOXANES AND RADICALLY POLYMERISABLE MONOMERS HOESCHT AKTIENGESELLSCHAFT (DE) 1994-05-11 WO disclosed
EP-0332670-A1 COLOURLESS TRANSPARENT POLYMER MATERIAL Carl-Zeiss-Stiftung trading as SCHOTT GLASWERKE (DE) 1989-09-20 EP disclosed
WO-1989001952-A1 COLOURLESS TRANSPARENT POLYMER MATERIAL SCHOTT GLASWERKE (DE) 1989-03-09 WO disclosed
US-4715999-A Process of making optical blanks SCHOTT GLASWERKE (DE) 1987-12-29 US disclosed
EP-0106991-B1 PROCESS FOR PREPARING COPOLYMERS OF MONOETHYLENICALLY UNSATURATED MONO- AND DICARBOXYLIC ACIDS (ANHYDRIDE) BASF Aktiengesellschaft (DE) 1987-05-13 EP disclosed