Citric Acid

Citric Acid

SCHEMBL6422668

CN(C)CCc1c(Cl)ccc2c1cc1n2Cc2ccccc2-1.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.40

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 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 known ✓ O00255 2/20 0.35
▸ ESR1 known ✓ P03372 1/20 0.33
▸ ESR2 known ✓ Q92731 1/20 0.33
▸ MTNR1A P48039 11/20 0.40
▸ MTNR1B P49286 11/20 0.40
▸ LMNA P02545 5/20 0.35
▸ KDM4E B2RXH2 5/20 0.35
▸ CYP1A2 P05177 3/20 0.35
▸ CYP2D6 P10635 3/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ AVPR2 P30518 1/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ CYP3A4 P08684 2/20 0.34
▸ CYP2C9 P11712 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ NFKB1 P19838 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ CYP2C19 P33261 2/20 0.34
▸ HIF1A Q16665 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34

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 SCHEMBL6422672 0.86 MTNR1A (0.41) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
Citric Acid SCHEMBL3253261 0.84 MTNR1A (0.59) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
Citric Acid SCHEMBL3248462 0.76 MTNR1A (0.57) MTNR1AMTNR1BLMNAKDM4ECYP1A2
Citric Acid SCHEMBL3248609 0.76 MTNR1A (0.55) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
SCHEMBL6425851 0.75 MTNR1A (0.38) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
Oxalic Acid SCHEMBL3250917 0.72 MTNR1A (0.67) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
Citric Acid SCHEMBL5101053 0.71 TACR1 (0.41) LMNAKDM4ECYP1A2CYP2D6MEN1
Citric Acid SCHEMBL3253262 0.71 MTNR1A (0.58) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
Citric Acid SCHEMBL3248466 0.70 MTNR1A (0.57) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6
Maleic Acid SCHEMBL3250853 0.70 MTNR1A (0.64) MTNR1AMTNR1BKDM4ECYP1A2CYP2D6

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-20050203103-A1 Arylalkyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them SUVEN LIFE SCIENCES LIMITED (IN) 2005-09-15 — — 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-20050203103-A1 Arylalkyl indoles having serotonin receptor affinity useful as therapeutic agents, process for their preparation and pharmaceutical compositions containing them TPH1, HTR1A, HTR7 MEN1 3998/4885ESR1 1952/4885ESR2 2487/4885

“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.

Send feedback