Citric Acid

Citric Acid

SCHEMBL6865211

COc1ccc(N(c2nc(N)nc(N(C)C3CCN(C)CC3)n2)C2CCCCCC2)cc1F.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.37

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 11)

geneUniProtsupporting neighboursconfidence
JAK2 known ✓ O60674 1/20 0.32
EHMT2 Q96KQ7 4/20 0.37
EHMT1 Q9H9B1 4/20 0.37
SLC2A1 P11166 1/20 0.35
QPCT Q16769 7/20 0.34
SPIN1 Q9Y657 1/20 0.34
QPCTL Q9NXS2 1/20 0.34
PIK3CA P42336 1/20 0.33
FFAR1 O14842 1/20 0.32
KMT5A Q9NQR1 1/20 0.32
HTR2A P28223 2/20 0.32

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
SCHEMBL6237774 0.89 EHMT2 (0.45) EHMT2EHMT1SLC2A1SPIN1PIK3CA
SCHEMBL5421592 0.79 EHMT2 (0.39) EHMT2EHMT1SLC2A1SPIN1PIK3CA
SCHEMBL6234157 0.79 NMT1 (0.37) EHMT2EHMT1HTR2AJAK2
SCHEMBL6919803 0.79 EHMT2 (0.45) EHMT2EHMT1SLC2A1SPIN1KMT5A
SCHEMBL6863012 0.78 SLC6A2 (0.34) EHMT2EHMT1SLC2A1SPIN1PIK3CA
SCHEMBL6430010 0.78 EHMT2 (0.37) EHMT2EHMT1SPIN1HTR2A
Citric Acid SCHEMBL4829665 0.77 EHMT2 (0.41) EHMT2EHMT1
SCHEMBL6921934 0.77 EHMT2 (0.38) EHMT2EHMT1SLC2A1SPIN1PIK3CA
Citric Acid SCHEMBL6016965 0.76 EHMT2 (0.43) EHMT2EHMT1
SCHEMBL6818739 0.75 SMN1; SMN2 (0.46) EHMT2EHMT1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040077648-A1 Methods and compositions of novel triazine compounds DR. REDDY'S LABORATORIES LTD. (IN) 2004-04-22 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20040077648-A1 Methods and compositions of novel triazine compounds AREG, TGFB1, PTGIS JAK2 114/4885EHMT2 2905/4885EHMT1 2811/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.