Bicarbonate

Bicarbonate

SCHEMBL20694841

CC(C)COc1ccccc1C(=O)O.O=C(O)O

nearest known ligand 0.57

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
ALDH1A1 P00352 6/20 0.57
KMT2A Q03164 2/20 0.57
PTK2B Q14289 1/20 0.57
KDM4E B2RXH2 5/20 0.56
HTT P42858 3/20 0.56
HSD17B10 Q99714 3/20 0.53
HPGD P15428 2/20 0.53
TSHR P16473 2/20 0.51
ESR1 P03372 1/20 0.51
ITGB3 P05106 1/20 0.51
ITGA2B P08514 1/20 0.51
HMGB1 P09429 1/20 0.51
GGT1 P19440 1/20 0.51
PTGS1 P23219 1/20 0.51
PTGS2 P35354 1/20 0.51
BLM P54132 1/20 0.51
NAPRT Q6XQN6 1/20 0.51
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 1/20 0.50
RECQL P46063 1/20 0.50

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
Benzene SCHEMBL28043964 1.00 ALDH1A1 (0.57) ALDH1A1KMT2APTK2BKDM4EHTT
Bicarbonate SCHEMBL29943829 1.00 ALDH1A1 (0.57) ALDH1A1KMT2APTK2BKDM4EHTT
Bicarbonate SCHEMBL236893 1.00 ALDH1A1 (0.57) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL477006 0.98 ALDH1A1 (0.59) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL17799583 0.97 ALDH1A1 (0.57) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL235783 0.88 ALDH1A1 (0.55) ALDH1A1KMT2APTK2BKDM4EHTT
Bicarbonate SCHEMBL27740097 0.85 ABCB1 (0.61) ALDH1A1TSHRABCB1
SCHEMBL30174106 0.85 ALDH1A1 (0.56) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL1268613 0.85 KDM4E (0.58) ALDH1A1KMT2APTK2BKDM4EHTT
SCHEMBL30136451 0.84 ALDH1A1 (0.59) ALDH1A1KMT2APTK2BKDM4EHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112654508-B Improved method for locally coloring plastic parts 科思创知识产权两合公司 2022-11-08 CN disclosed
EP-4073151-A1 FILMS HAVING SPECIAL PROPERTIES Covestro Intellectual Property GmbH & Co. KG (DE) 2022-10-19 EP disclosed
EP-3880474-A1 PLASTIC FILMS HAVING HIGH OPACITY AND LOW TRANSPARENCY FOR ID DOCUMENTS HAVING A TRANSPARENT WINDOW Covestro Intellectual Property GmbH & Co. KG (DE) 2021-09-22 EP disclosed
EP-3849794-A1 METHOD FOR MANUFACTURING A LAMINATE WHICH COMPRISES ELECTRONIC COMPONENTS AND/OR FUNTIONAL UNITS Covestro Intellectual Property GmbH & Co. KG (DE) 2021-07-21 EP disclosed
WO-2021116356-A1 FILMS HAVING SPECIAL PROPERTIES COVESTRO INTELLECTUAL PROPERTY GMBH & CO. KG (DE) 2021-06-17 WO disclosed
EP-3630875-A1 FILMS HAVING A SCRATCH-RESISTANT COATING AS A COVER LAYER AND LAYERED COMPOSITES COMPRISING SUCH FILMS Covestro Deutschland AG (DE) 2020-04-08 EP disclosed
WO-2020053169-A1 METHOD FOR MANUFACTURING A LAMINATE WHICH COMPRISES ELECTRONIC COMPONENTS AND/OR FUNTIONAL UNITS COVESTRO DEUTSCHLAND AG (DE) 2020-03-19 WO disclosed
EP-3623148-A1 METHOD FOR THE PRODUCTION OF A LAMINATE COMPRISING ELECTRONIC COMPONENTS AND/OR FUNCTIONAL UNITS Covestro Deutschland AG (DE) 2020-03-18 EP disclosed
CN-105829396-B Preparation of siloxane-containing block copolycarbonates by reactive extrusion 科思创德国股份有限公司 2019-12-20 CN disclosed
EP-3436284-A1 METHOD FOR THE PARTIAL COLORING OF PLASTIC PARTS Covestro Deutschland AG (DE) 2019-02-06 EP disclosed