Citric Acid

Citric Acid

SCHEMBL4932703

CN(C)C(=O)C(Cc1cscn1)CN1C2CCC1CC1(C2)OCc2ccccc21.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.51

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 8)

geneUniProtsupporting neighboursconfidence
SCN9A known ✓ Q15858 1/20 0.30
OPRL1 P41146 5/20 0.51
OPRD1 P41143 1/20 0.32
ADRA1A P35348 2/20 0.31
MCHR1 Q99705 2/20 0.31
NPY5R Q15761 1/20 0.31
AVPR1A P37288 5/20 0.31
HRH3 Q9Y5N1 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
SCHEMBL4936147 0.93 OPRL1 (0.57) OPRL1OPRD1ADRA1AMCHR1NPY5R
Citric Acid SCHEMBL4943418 0.91 OPRL1 (0.64) OPRL1MCHR1
Citric Acid SCHEMBL4977853 0.86 OPRL1 (0.69) OPRL1ADRA1AMCHR1HRH3
SCHEMBL4888999 0.85 OPRL1 (0.46) OPRL1OPRD1AVPR1A
Trifluoroacetic Acid SCHEMBL4898487 0.84 OPRL1 (0.44) OPRL1OPRD1AVPR1A
SCHEMBL4933523 0.83 OPRL1 (0.73) OPRL1OPRD1MCHR1NPY5R
Citric Acid SCHEMBL4936359 0.82 OPRL1 (0.42) OPRL1ADRA1AMCHR1NPY5RAVPR1A
SCHEMBL4797089 0.82 OPRL1 (0.43) OPRL1AVPR1ASCN9A
SCHEMBL4898494 0.80 OPRL1 (0.43) OPRL1OPRD1AVPR1A
Citric Acid SCHEMBL4977843 0.80 OPRL1 (0.60) OPRL1ADRA1AMCHR1HRH3

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 SCN9A 197/4885OPRL1 1/4885OPRD1 2/4885

“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.