Bicarbonate

Bicarbonate

SCHEMBL7732891

CC1(C23CC4CC(CC(C4)C2)C3)CCCCC1.O=C(O)O

nearest known ligand 0.45

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 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
HSD11B1 P28845 2/20 0.36
THRB P10828 1/20 0.34
CYP2C9 P11712 1/20 0.34
EPHX1 P07099 4/20 0.34
TSHR P16473 1/20 0.34
EPHX2 P34913 2/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
GAA P10253 1/20 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 SCHEMBL7739293 1.00 ALDH1A1 (0.38) ALDH1A1L3MBTL1HSD11B1THRBCYP2C9
SCHEMBL7739288 0.89 L3MBTL1 (0.38) ALDH1A1L3MBTL1HSD11B1THRBCYP2C9
Bicarbonate SCHEMBL7732737 0.87 L3MBTL1 (0.36) ALDH1A1L3MBTL1HSD11B1THRBCYP2C9
SCHEMBL7732726 0.78 ALDH1A1 (0.35) ALDH1A1L3MBTL1HSD11B1EPHX1TSHR
SCHEMBL9141081 0.78 GRIN2D (0.38) THRBTSHRMAPT
SCHEMBL4814394 0.70
SCHEMBL16314093 0.68 HSD11B1 (0.44) ALDH1A1L3MBTL1HSD11B1TSHRSCN1A
SCHEMBL9146797 0.67 HSD11B1 (0.33) ALDH1A1L3MBTL1HSD11B1THRBEPHX1
Bicarbonate SCHEMBL28147558 0.65 THRB (0.35) ALDH1A1HSD11B1THRBCYP2C9EPHX1
Bicarbonate SCHEMBL27924222 0.65 THRB (0.35) ALDH1A1HSD11B1THRBCYP2C9EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6410748-B1 Alicycli c group-containing monomer KABUSHIKI KAISHA TOSHIBA (JP) 2002-06-25 US disclosed
US-6291129-B1 LIGHT SENSITIVE ELEMENT WITH UNSATURATED POLYMERS KABUSHIKI KAISHA TOSHIBA (JP) 2001-09-18 US disclosed