Citric Acid

Citric Acid

SCHEMBL6396207

O=C(O)CC(O)(CC(=O)O)C(=O)O.O=C([C@@H]1Cc2ccccc2N1C(=O)CCN1CCC2(CCc3ccccc32)CC1)N1CCOCC1

nearest known ligand 0.42

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 7)

geneUniProtsupporting neighboursconfidence
OPRM1 known ✓ P35372 5/20 0.42
HTR7 known ✓ P34969 2/20 0.42
SIGMAR1 known ✓ Q99720 3/20 0.39
OPRL1 P41146 15/20 0.42
HTR1A P08908 2/20 0.42
SLC18A3 Q16572 1/20 0.39
OPRK1 P41145 3/20 0.39

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 SCHEMBL7069932 1.00 OPRL1 (0.42) OPRL1OPRM1HTR1AHTR7SIGMAR1
Citric Acid SCHEMBL6396515 0.93 OPRL1 (0.42) OPRL1OPRM1SIGMAR1SLC18A3OPRK1
Citric Acid SCHEMBL6402947 0.93 OPRL1 (0.42) OPRL1OPRM1HTR1AHTR7SIGMAR1
Citric Acid SCHEMBL6395825 0.92 OPRL1 (0.43) OPRL1OPRM1HTR1AHTR7SIGMAR1
SCHEMBL6397610 0.92 OPRL1 (0.47) OPRL1OPRM1HTR1AHTR7SIGMAR1
SCHEMBL6397606 0.92 OPRL1 (0.47) OPRL1OPRM1HTR1AHTR7SIGMAR1
Hydrochloric Acid SCHEMBL6396517 0.91 OPRL1 (0.46) OPRL1OPRM1HTR1AHTR7SIGMAR1
Citric Acid SCHEMBL6394809 0.91 OPRL1 (0.42) OPRL1OPRM1SIGMAR1SLC18A3OPRK1
Citric Acid SCHEMBL6402640 0.90 OPRL1 (0.41) OPRL1OPRM1SIGMAR1SLC18A3OPRK1
Citric Acid SCHEMBL6703771 0.89 OPRL1 (0.41) OPRL1OPRM1SIGMAR1SLC18A3OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050038060-A1 Spiropoperidine compounds as ligands for orl-1 receptor ANDO KOJI (JP) 2005-02-17 US disclosed
US-20030078279-A1 Spiropiperidine compounds as ligands for ORL-1receptor PFIZER INC. 2003-04-24 US disclosed
US-20030078278-A1 Spiropiperidine compounds as ligands for ORL-1 receptor PFIZER INC. 2003-04-24 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 (3 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-20030078278-A1 Spiropiperidine compounds as ligands for ORL-1 receptor OPRL1, OPRD1, OXER1 OPRM1 10/4885HTR7 1608/4885SIGMAR1 9/4885
US-20030078279-A1 Spiropiperidine compounds as ligands for ORL-1receptor OPRL1, OPRD1, OXER1 OPRM1 11/4885HTR7 1552/4885SIGMAR1 13/4885
US-20050038060-A1 Spiropoperidine compounds as ligands for orl-1 receptor OPRL1, OXER1, OGFRL1 OPRM1 14/4885HTR7 2187/4885SIGMAR1 11/4885

“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.