Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4111745

CCCCCCC1=[N+](Cc2ccccc2F)CCc2cc3c(cc21)OCO3.[Cl-]

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

The experimentally established mechanism targets of Hydrochloric 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
ACHE known ✓ P22303 1/20 0.34
P2RX7 Q99572 1/20 0.37
SCN1A P35498 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
BCHE P06276 1/20 0.34
PREP P48147 1/20 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
Hydrochloric Acid SCHEMBL4104612 1.00 P2RX7 (0.37) P2RX7SCN1ASCN2ASCN3ABCHE
Hydrochloric Acid SCHEMBL4109094 1.00 P2RX7 (0.37) P2RX7SCN1ASCN2ASCN3ABCHE
Hydrochloric Acid SCHEMBL4107268 1.00 P2RX7 (0.37) P2RX7SCN1ASCN2ASCN3ABCHE
SCHEMBL4764613 0.99 SCN1A (0.35) P2RX7SCN1ASCN2ASCN3ABCHE
SCHEMBL4766333 0.99 SCN1A (0.35) P2RX7SCN1ASCN2ASCN3ABCHE
SCHEMBL4770550 0.99 SCN1A (0.35) P2RX7SCN1ASCN2ASCN3ABCHE
Hydrochloric Acid SCHEMBL4105929 0.99 P2RX7 (0.37) P2RX7SCN1ASCN2ASCN3ABCHE
SCHEMBL4770351 0.98 SCN1A (0.36) P2RX7SCN1ASCN2ASCN3ABCHE
Hydrochloric Acid SCHEMBL4098809 0.92 P2RX7 (0.39) P2RX7BCHEACHEPREP
SCHEMBL4770331 0.91 P2RX7 (0.37) P2RX7BCHEACHEPREP

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-20090221829-A1 3,4-Dihydroisoquinolinium Salt Derivatives HANWHA CHEMICAL CORPORATION (KR) 2009-09-03 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-20090221829-A1 3,4-Dihydroisoquinolinium Salt Derivatives KCNQ3, KCNQ1, KCNQ2 ACHE 984/4885P2RX7 2386/4885SCN1A 165/4885

“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.