Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4113796

Fc1ccccc1C[N+]1=C(c2cccc(Cl)c2)c2cc3c(cc2CC1)OCO3.[Cl-]

nearest known ligand 0.40

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 17)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 4/20 0.37
P2RX7 Q99572 1/20 0.40
BCHE P06276 4/20 0.37
PREP P48147 4/20 0.37
NPC1 O15118 2/20 0.34
RAB9A P51151 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
METTL3 Q86U44 1/20 0.32
METTL14 Q9HCE5 1/20 0.32
ALDH1A1 P00352 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
HPGD P15428 1/20 0.31

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 SCHEMBL4098418 0.90 P2RX7 (0.39) P2RX7BCHEACHEPREPNPC1
Hydrochloric Acid SCHEMBL4113599 0.89 SMN1; SMN2 (0.38) P2RX7BCHEACHEPREPNPC1
Hydrochloric Acid SCHEMBL4098070 0.84 P2RX7 (0.38) P2RX7BCHEACHEPREPNPC1
Hydrochloric Acid SCHEMBL4109078 0.83 MAPK10 (0.46) P2RX7BCHEACHEPREP
SCHEMBL4829233 0.82 MAPK10 (0.47) P2RX7BCHEACHE
Hydrochloric Acid SCHEMBL4103480 0.81 P2RX7 (0.36) P2RX7BCHEACHEPREPNPC1
SCHEMBL4892415 0.80 SMN1; SMN2 (0.36) P2RX7BCHEACHEPREPNPC1
Hydrochloric Acid SCHEMBL4102832 0.79 P2RX7 (0.34) P2RX7BCHEACHEPREPNPC1
Hydrochloric Acid SCHEMBL4109295 0.79 P2RX7 (0.40) P2RX7BCHEACHEPREPNPC1
SCHEMBL4900648 0.78 SCN1A (0.35) P2RX7BCHEACHEPREPNPC1

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 2386/4885BCHE 1438/4885

“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.