Citric Acid

Citric Acid

SCHEMBL4932708

CN(C)C(=O)C(CN1C2CCC1CC1(C2)OCc2ccc(F)cc21)Cn1cccn1.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.41

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 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 4/20 0.41
MCHR1 Q99705 3/20 0.36
ADRA1A P35348 1/20 0.36
NPY5R Q15761 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
SCHEMBL4932624 0.93 OPRL1 (0.46) OPRL1MCHR1ADRA1ANPY5R
Citric Acid SCHEMBL4936359 0.91 OPRL1 (0.42) OPRL1MCHR1ADRA1ANPY5R
Citric Acid SCHEMBL4932379 0.90 OPRL1 (0.47) OPRL1MCHR1ADRA1A
Citric Acid SCHEMBL4974617 0.86 OPRL1 (0.57) OPRL1MCHR1ADRA1A
SCHEMBL4900212 0.85 OPRL1 (0.36) OPRL1MCHR1ADRA1A
Citric Acid SCHEMBL4940620 0.84 OPRL1 (0.49) OPRL1MCHR1ADRA1A
SCHEMBL4935988 0.83 OPRL1 (0.47) OPRL1MCHR1ADRA1ANPY5R
Citric Acid SCHEMBL4943418 0.82 OPRL1 (0.64) OPRL1MCHR1
SCHEMBL4898569 0.82 OPRL1 (0.36) OPRL1MCHR1ADRA1A
SCHEMBL4936588 0.82 OPRL1 (0.53) OPRL1MCHR1ADRA1A

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-20080200490-A1 Alpha-(Aryl-or Heteroaryl-Methyl)-Beta-Piperidino Propanamide Compounds as Orl-1-Receptor Antagonists PFIZER INC. 2008-08-21 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-20080200490-A1 Alpha-(Aryl-or Heteroaryl-Methyl)-Beta-Piperidino Propanamide Compounds as Orl-1-Receptor Antagonists OPRL1, OPRD1, OGFRL1 OPRL1 1/4885MCHR1 336/4885ADRA1A 36/4885

“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.