Bicarbonate

Bicarbonate

SCHEMBL6732703

O=C(O)O.c1ccc(N(c2ccccc2)c2ccccc2)cc1

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
NPSR1 Q6W5P4 2/20 0.57
ALDH1A1 P00352 7/20 0.55
L3MBTL1 Q9Y468 3/20 0.55
TDP1 Q9NUW8 2/20 0.55
KDM4E B2RXH2 1/20 0.55
CYP1A2 P05177 1/20 0.55
CYP3A4 P08684 1/20 0.55
CYP2D6 P10635 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
TSHR P16473 2/20 0.52
GLA P06280 1/20 0.52
KMT2A Q03164 4/20 0.50
MEN1 O00255 3/20 0.50
ATM Q13315 2/20 0.50
CRHBP P24387 1/20 0.50
CRHR2 Q13324 1/20 0.50
TLR9 Q9NR96 1/20 0.50
HTT P42858 2/20 0.46

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
Oxalic Acid SCHEMBL21145209 0.91 NPSR1 (0.55) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
Oxalic Acid SCHEMBL21145207 0.91 NPSR1 (0.55) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
Urea SCHEMBL28310191 0.88 ALDH1A1 (0.56) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
Acetic Acid SCHEMBL21145121 0.88 ALDH1A1 (0.54) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
Acetone SCHEMBL11330473 0.88 ALDH1A1 (0.54) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
Benzene SCHEMBL28083527 0.87 ALDH1A1 (0.67) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL453160 0.87 ALDH1A1 (0.67) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL30959 0.87 ALDH1A1 (0.67) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
SCHEMBL9490577 0.87 ALDH1A1 (0.67) NPSR1ALDH1A1L3MBTL1TDP1KDM4E
Acetic Acid SCHEMBL10361780 0.86 ALDH1A1 (0.52) NPSR1ALDH1A1L3MBTL1TDP1KDM4E

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-20040208990-A1 Coating liquid for forming organic LED layer and method of manufacturing organic LED device using it SHARP KABUSHIKI KAISHA (JP) 2004-10-21 US disclosed
US-20010003602-A1 Coating liquid for forming organic led layer and method of manufacturing organic led device using it SHARP KABUSHIKI KAISHA (JP) 2001-06-14 US disclosed