Citric Acid

Citric Acid

SCHEMBL7006259

Cl.O=C(O)CC(O)(CC(=O)O)C(=O)[O-].[K+]

nearest known ligand 0.56

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 16)

geneUniProtsupporting neighboursconfidence
CA4 P22748 1/20 0.56
ALDH1A1 P00352 1/20 0.55
HMGCR P04035 1/20 0.42
CHRM1 P11229 1/20 0.42
TBXA2R P21731 1/20 0.42
ADRA1A P35348 1/20 0.42
KDM4E B2RXH2 1/20 0.36
CYP2D6 P10635 1/20 0.35
TSHR P16473 1/20 0.35
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
ACLY P53396 3/20 0.34
CPT2 P23786 2/20 0.33
SLC13A5 Q86YT5 2/20 0.32
FFAR1 O14842 1/20 0.31
TDP1 Q9NUW8 1/20 0.31

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 SCHEMBL183004 0.97 CA4 (0.59) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL19063541 0.95 CA4 (0.56) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL6265385 0.92 CA4 (0.61) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL2890971 0.92 CA4 (0.67) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL10477647 0.92 CA4 (0.67) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL33988 0.92 CA4 (0.59) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL5190913 0.92 CA4 (0.59) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL7517100 0.92 CA4 (0.59) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL73102 0.92 CA4 (0.67) CA4ALDH1A1HMGCRCHRM1TBXA2R
Citric Acid SCHEMBL1684058 0.92 CA4 (0.59) CA4ALDH1A1HMGCRCHRM1TBXA2R

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
EP-1267809-A1 HAIR COLOURING AND CONDITIONING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2003-01-02 EP disclosed
WO-2001076545-A1 HAIR COLOURING AND CONDITIONING COMPOSITIONS THE PROCTER & GAMBLE COMPANY (US) 2001-10-18 WO disclosed