Citric Acid

Citric Acid

SCHEMBL9255586

CN(C[C@@H](CCN1CCC(C(=O)N2CCCC2)(N2CCCNC2=O)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1.O=C(O)CC(O)(CC(=O)O)C(=O)O

nearest known ligand 0.58

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 2)

geneUniProtsupporting neighboursconfidence
TACR1 known ✓ P25103 2/20 0.58
TACR2 P21452 14/20 0.58

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
SCHEMBL8828888 0.94 TACR2 (0.66) TACR2TACR1
Citric Acid SCHEMBL8940484 0.91 TACR2 (0.58) TACR2TACR1
Citric Acid SCHEMBL8940494 0.91 TACR2 (0.58) TACR2TACR1
Citric Acid SCHEMBL8940427 0.91 TACR2 (0.59) TACR2TACR1
Citric Acid SCHEMBL9050091 0.90 TACR2 (0.61) TACR2TACR1
SCHEMBL8829018 0.84 TACR2 (0.64) TACR2TACR1
SCHEMBL8828883 0.84 TACR2 (0.64) TACR2TACR1
Citric Acid SCHEMBL8940410 0.84 TACR2 (0.60) TACR2TACR1
Citric Acid SCHEMBL8940339 0.84 TACR2 (0.60) TACR2TACR1
Citric Acid SCHEMBL8940461 0.83 TACR2 (0.62) TACR2TACR1

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
WO-1995012577-A1 NOVEL 4-PIPERIDINYL SUBSTITUTED LACTAMES AS NEUROKININ 2 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF ASTHMA ZENECA LIMITED (GB) 1995-05-11 WO disclosed