Citric Acid

Citric Acid

SCHEMBL27903186

O.O.O=C(O)CC(O)(CC(=O)O)C(=O)O.[NaH].[NaH].c1ccncc1

nearest known ligand 0.60

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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 18)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.39
ALDH1A1 P00352 2/20 0.60
SLC13A5 Q86YT5 12/20 0.42
LMNA P02545 3/20 0.41
KDM4E B2RXH2 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2D6 P10635 2/20 0.39
KMT2A Q03164 1/20 0.39
TSHR P16473 2/20 0.36
NAPRT Q6XQN6 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
HIF1A Q16665 1/20 0.34
HMGCR P04035 1/20 0.33
CHRM1 P11229 1/20 0.33
TBXA2R P21731 1/20 0.33
ADRA1A P35348 1/20 0.33

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 SCHEMBL28787546 0.96 ALDH1A1 (0.65) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL1666464 0.96 ALDH1A1 (0.65) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL1666467 0.96 ALDH1A1 (0.65) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL27413422 0.86 ALDH1A1 (0.62) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL29150802 0.83 ALDH1A1 (0.65) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL372189 0.82 ALDH1A1 (0.88) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL13684439 0.82 ALDH1A1 (0.88) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL1550236 0.82 ALDH1A1 (0.88) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL21753855 0.82 ALDH1A1 (0.88) ALDH1A1SLC13A5LMNAKDM4ECYP1A2
Citric Acid SCHEMBL20917177 0.82 ALDH1A1 (0.88) ALDH1A1SLC13A5LMNAKDM4ECYP1A2

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-103113348-B Pseudo-polymorphic form of desloratadine citrate disodium and preparation method thereof HAICI BIOLOG PHARMACEUTICAL CO LTD OF YANGTZE RIVERS PHARMACEUTICAL GROUP 2015-03-25 CN disclosed
CN-103113348-A Pseudo-polymorphic form of desloratadine citrate disodium and preparation method thereof HAICI BIOLOG PHARMACEUTICAL CO LTD OF YANGTZE RIVERS PHARMACEUTICAL GROUP 2013-05-22 CN disclosed