Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4098809

CCCC1=[N+](Cc2ccccc2F)CCc2cc3c(cc21)OCO3.[Cl-]

nearest known ligand 0.39

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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 5/20 0.36
CHRM1 known ✓ P11229 1/20 0.35
P2RX7 Q99572 1/20 0.39
BCHE P06276 5/20 0.36
PREP P48147 4/20 0.36
DRD1 P21728 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
MAPT P10636 1/20 0.35
DRD2 P14416 1/20 0.35
TSHR P16473 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
RXRA P19793 1/20 0.35
HTR2B P41595 1/20 0.35
HTT P42858 1/20 0.35
RAD52 P43351 1/20 0.35

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
SCHEMBL4770331 0.99 P2RX7 (0.37) P2RX7BCHEACHEPREPDRD1
Hydrochloric Acid SCHEMBL4105929 0.93 P2RX7 (0.37) P2RX7BCHEACHEPREPDRD1
Hydrochloric Acid SCHEMBL4107268 0.92 P2RX7 (0.37) P2RX7BCHEACHEPREP
Hydrochloric Acid SCHEMBL4104612 0.92 P2RX7 (0.37) P2RX7BCHEACHEPREP
Hydrochloric Acid SCHEMBL4109094 0.92 P2RX7 (0.37) P2RX7BCHEACHEPREP
Hydrochloric Acid SCHEMBL4111745 0.92 P2RX7 (0.37) P2RX7BCHEACHEPREP
SCHEMBL4770351 0.91 SCN1A (0.36) P2RX7BCHEACHEPREPDRD1
Hydrochloric Acid SCHEMBL4103826 0.91 P2RX7 (0.40) P2RX7BCHEACHEPREPDRD1
SCHEMBL4770550 0.90 SCN1A (0.35) P2RX7BCHEACHEPREP
SCHEMBL4764613 0.90 SCN1A (0.35) 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 984/4885CHRM1 2027/4885P2RX7 2386/4885

“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.