Bicarbonate

Bicarbonate

SCHEMBL14796752

CC1(C)Cc2cc(F)cc(COc3c(F)cc(CC4CC4)cc3F)c2O1.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 7)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 11/20 0.43
GYS1 P13807 1/20 0.39
KDM5A P29375 1/20 0.36
KDM4C Q9H3R0 1/20 0.36
KMT2A Q03164 1/20 0.36
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.32

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 SCHEMBL14796800 0.91 FFAR4 (0.52) FFAR4GYS1KDM5AKDM4CKMT2A
Bicarbonate SCHEMBL14796865 0.86 GYS1 (0.47) FFAR4GYS1KDM5AKDM4CKMT2A
Bicarbonate SCHEMBL14796945 0.86 FFAR4 (0.44) FFAR4GYS1KDM5AKDM4CKMT2A
SCHEMBL12071510 0.85 FFAR4 (0.42) FFAR4GYS1KDM5AKDM4CKMT2A
SCHEMBL2432157 0.85 FFAR4 (0.42) FFAR4GYS1KDM5AKDM4CKMT2A
SCHEMBL2431752 0.83 FFAR4 (0.46) FFAR4GYS1KDM5AKDM4CKMT2A
SCHEMBL2434569 0.82 FFAR4 (0.54) FFAR4
SCHEMBL2435182 0.81 FFAR4 (0.42) FFAR4GYS1KDM5AKDM4CKMT2A
SCHEMBL2432503 0.80 FFAR4 (0.41) FFAR4KDM5AKDM4CKMT2A
SCHEMBL2433864 0.78 FFAR4 (0.51) FFAR4GYS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2367793-B1 GPR120 RECEPTOR AGONISTS AND USES THEREOF METABOLEX INC (US) 2013-03-27 EP claimed