Citric Acid

Citric Acid

SCHEMBL9844312

CCCN1CCOCC1NC(=O)CCCCCCCCCCCCCCC(C)C.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

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 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.34
LMNA P02545 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MAPT P10636 1/20 0.34
ALOX15 P16050 1/20 0.34
TSHR P16473 1/20 0.34
HTT P42858 1/20 0.32
OPRD1 P41143 1/20 0.31
PLA2G10 O15496 1/20 0.30
KDM4C Q9H3R0 2/20 0.30
KDM4A O75164 1/20 0.30
PHF8 Q9UPP1 1/20 0.30
KDM2A Q9Y2K7 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
SLC13A5 Q86YT5 1/20 0.30

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 SCHEMBL9844145 0.91 OPRD1 (0.37) ALDH1A1LMNAKDM4EMAPTALOX15
SCHEMBL122497 0.89 TRPV1 (0.35) ALDH1A1LMNAMAPTHTTSMN1; SMN2
Acetic Acid SCHEMBL9844165 0.88 TRPV1 (0.33) ALDH1A1LMNAMAPTHTTPLA2G10
Lactic Acid SCHEMBL6445485 0.86 FAAH (0.36) ALDH1A1LMNAMAPTHTTPLA2G10
Phosphoric Acid SCHEMBL9844199 0.85 ALDH1A1 (0.33) ALDH1A1LMNAMAPTTSHRHTT
SCHEMBL123770 0.79 TRPV1 (0.46) ALDH1A1LMNAHTTSMN1; SMN2
Acetic Acid SCHEMBL9844375 0.78 TRPV1 (0.43) ALDH1A1LMNAMAPTHTTSMN1; SMN2
Phosphoric Acid SCHEMBL9844239 0.75 TRPV1 (0.42) ALDH1A1LMNAHTTSMN1; SMN2
Citric Acid SCHEMBL29265484 0.69 HSPD1 (0.55) ALDH1A1MAPT
Citric Acid SCHEMBL29657509 0.69 ALDH1A1 (0.52) ALDH1A1LMNAALOX15TSHRKDM4C

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-0410659-A2 Method and composition to impart improved conditioning properties to the hair HELENE CURTIS, INC. (US) 1991-01-30 EP claimed
US-4976956-A Water soluble and oil soluble quaternary ammonium compounds and amidoamine HELENE CURTIS, INC. (US) 1990-12-11 US claimed