Citric Acid

Citric Acid

SCHEMBL6238056

Nc1ccccc1N.O=C(O)CC(O)(CC(=O)O)C(=O)[O-].[Na+]

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACVR1ADORA1ADORA2AADORA2BADORA3ESR1ESR2FLT3GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSC1GSK3AGSK3BHRH1HRH2HTR7IDH1IDH2IMPA1IRAK1JAK1JAK2JAK3MEN1OPRM1P2RX3PDE5ASCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASIGMAR1SLC6A2SYKTACR1TOP2ATYK2

The experimentally established mechanism targets of Citric Acid. 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
MEN1 known ✓ O00255 1/20 0.36
CA4 P22748 2/20 0.45
SLC13A5 Q86YT5 6/20 0.41
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
CYP2C19 P33261 1/20 0.39
HIF1A Q16665 1/20 0.39
ALDH1A1 P00352 1/20 0.39
TDP1 Q9NUW8 1/20 0.37
CA2 P00918 1/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2D6 P10635 1/20 0.36
KMT2A Q03164 1/20 0.36
CYP3A4 P08684 1/20 0.36
ALOX15 P16050 1/20 0.36
CASP1 P29466 1/20 0.36
CASP7 P55210 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36

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
Citric Acid SCHEMBL6238060 0.87 CA4 (0.63) CA4GAAMAPTALDH1A1CA2
Citric Acid SCHEMBL6238058 0.87 CA4 (0.63) CA4GAAMAPTALDH1A1CA2
Citric Acid SCHEMBL29054134 0.84 CA4 (0.57) CA4GAAMAPTALDH1A1TDP1
Citric Acid SCHEMBL5064884 0.83 ALDH1A1 (0.60) SLC13A5GAAMAPTCYP2C19HIF1A
Citric Acid SCHEMBL29054131 0.81 ALDH1A1 (0.58) SLC13A5GAAMAPTCYP2C19HIF1A
Citric Acid SCHEMBL73102 0.80 CA4 (0.67) CA4SLC13A5CYP2C19HIF1AALDH1A1
Citric Acid SCHEMBL2890971 0.80 CA4 (0.67) CA4SLC13A5CYP2C19HIF1AALDH1A1
Citric Acid SCHEMBL10477647 0.80 CA4 (0.67) CA4SLC13A5CYP2C19HIF1AALDH1A1
Citric Acid SCHEMBL106889 0.79 CA4 (0.41) CA4SLC13A5CYP2C19HIF1AALDH1A1
Citric Acid SCHEMBL104572 0.79 CA4 (0.41) CA4SLC13A5CYP2C19HIF1AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1119346-B1 RNA CANCER VACCINE AND METHODS FOR ITS USE WAYNE JOHN CANCER INST (US) 2005-06-01 EP disclosed
US-6472375-B1 DNA vaccine and methods for its use JOHN WAYNE CANCER INSTITUTE 2002-10-29 US disclosed
US-6432925-B1 TUMOR ANTIGEN JOHN WAYNE CANCER INSTITUTE 2002-08-13 US disclosed
EP-1119346-A2 RNA CANCER VACCINE AND METHODS FOR ITS USE John Wayne Cancer Institute (US) 2001-08-01 EP disclosed
EP-1108028-A2 DNA CANCER VACCINE AND METHODS FOR ITS USE John Wayne Cancer Institute (US) 2001-06-20 EP disclosed
WO-2000012127-A2 DNA CANCER VACCINE AND METHODS FOR ITS USE JOHN WAYNE CANCER INSTITUTE (US) 2000-03-09 WO disclosed
WO-1999052503-A2 RNA CANCER VACCINE AND METHODS FOR ITS USE JOHN WAYNE CANCER INSTITUTE (US) 1999-10-21 WO disclosed