Citric Acid

Citric Acid

SCHEMBL9520797

CNC(CCCc1ccc2ccccc2c1)c1ccc(C)cc1.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.55

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 17)

geneUniProtsupporting neighboursconfidence
MEN1 known ✓ O00255 1/20 0.40
GRIN2D known ✓ O15399 1/20 0.38
GRIN2A known ✓ Q12879 1/20 0.38
GRIN2B known ✓ Q13224 1/20 0.38
GRIN2C known ✓ Q14957 1/20 0.38
SIGMAR1 known ✓ Q99720 1/20 0.36
SLC13A5 Q86YT5 4/20 0.55
CYP1A2 P05177 2/20 0.44
KDM4E B2RXH2 1/20 0.40
LMNA P02545 1/20 0.40
CYP2D6 P10635 1/20 0.40
KMT2A Q03164 1/20 0.40
HDAC1 Q13547 2/20 0.40
CTSA P10619 1/20 0.38
UTS2R Q9UKP6 4/20 0.38
HDAC8 Q9BY41 1/20 0.38
HCAR2 Q8TDS4 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 SCHEMBL9520794 1.00 SLC13A5 (0.55) SLC13A5CYP1A2KDM4EMEN1LMNA
Citric Acid SCHEMBL9613830 0.82 SLC13A5 (0.42) SLC13A5CYP1A2KDM4EMEN1LMNA
Citric Acid SCHEMBL9518970 0.78 SLC13A5 (0.59) SLC13A5CYP1A2KDM4EMEN1LMNA
Citric Acid SCHEMBL9518963 0.78 SLC13A5 (0.59) SLC13A5CYP1A2KDM4EMEN1LMNA
Citric Acid SCHEMBL9520803 0.76 SLC13A5 (0.57) SLC13A5CYP1A2KDM4EMEN1LMNA
SCHEMBL10484411 0.75 SLC13A5 (0.53) SLC13A5CYP1A2KDM4EMEN1LMNA
Decanoic Acid SCHEMBL9519013 0.74 CYP1A2 (0.51) CYP1A2LMNACYP2D6HDAC1UTS2R
Decanoic Acid SCHEMBL9519009 0.74 CYP1A2 (0.51) CYP1A2LMNACYP2D6HDAC1UTS2R
SCHEMBL27396500 0.70 CYP1A2 (0.57) SLC13A5CYP1A2CYP2D6HDAC1GRIN2D
Citric Acid SCHEMBL10484280 0.69 SLC13A5 (0.39) SLC13A5CYP1A2KDM4EMEN1LMNA

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-0318234-B1 IMPROVEMENTS IN OR RELATING TO SELECTIVE SEROTONIN UPTAKE INHIBITORS ELI LILLY AND COMPANY (US) 1993-03-17 EP disclosed
US-4876282-A ANTIDEPRESSANT, DIETETICS, ANTIALCOHOLISM AGENT ELI LILLY AND COMPANY (US) 1989-10-24 US disclosed