Citric Acid

Citric Acid

SCHEMBL27500656

O=C(O)CC(O)(CC(=O)O)C(=O)O.O=C(O)CC(O)C(=O)O.O=C(O)Cc1ccccc1

nearest known ligand 0.49

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Known targets — ChEMBL curated mechanism

ACVR1ADORA1ADORA2AADORA2BADORA3ESR1ESR2FLT3GRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BGSC1HRH1HTR7IDH1IDH2IRAK1JAK1JAK2JAK3MEN1OPRM1P2RX3PDE5ASCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9ASIGMAR1SLC6A2SYKTACR1TOP2ATYK2

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 0.45
AKR1B1 P15121 1/20 0.49
LMNA P02545 4/20 0.45
KDM4E B2RXH2 3/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
KMT2A Q03164 1/20 0.45
SLC13A5 Q86YT5 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CPA1 P15085 2/20 0.41
CPB1 P15086 1/20 0.41
CPA3 P15088 1/20 0.41
CPB2 Q96IY4 1/20 0.41
ABCC4 O15439 1/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
PTGS1 P23219 1/20 0.40
HTT P42858 1/20 0.40
FFAR1 O14842 1/20 0.37

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 SCHEMBL27471655 0.86 AKR1B1 (0.65) AKR1B1LMNAKDM4EMEN1CYP1A2
Citric Acid SCHEMBL6023385 0.83 LMNA (0.51) LMNAKDM4EMEN1CYP1A2CYP2D6
Citric Acid SCHEMBL290601 0.83 ALDH1A1 (0.62) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR
Citric Acid SCHEMBL28954897 0.81 ALDH1A1 (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR
Citric Acid SCHEMBL28954903 0.81 ALDH1A1 (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR
Citric Acid SCHEMBL3647975 0.81 SMN1; SMN2 (0.60) SMN1; SMN2ALDH1A1ACLY
Citric Acid SCHEMBL3955190 0.81 ALDH1A1 (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR
Citric Acid SCHEMBL247921 0.81 ALDH1A1 (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR
Citric Acid SCHEMBL6662533 0.81 ALDH1A1 (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR
Citric Acid SCHEMBL28954908 0.81 ALDH1A1 (0.60) LMNAKDM4ESMN1; SMN2ALDH1A1TSHR

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
CN-1183046-C Method of purifying water, suitable bacteria for said method and use thereof 2005-01-05 CN disclosed
CN-1420848-A Water treatment method, microorganism suitable for the method and use thereof CLEVO OY (FI) 2003-05-28 CN disclosed