Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4097852

CCCCCCCC1=[N+](Cc2ccc(C)cc2)CCc2cc(OC)c(OC)cc21.[Cl-]

nearest known ligand 0.46

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 2/20 0.46
COL1A1 P02452 1/20 0.41
P2RX7 Q99572 1/20 0.37
PPARG P37231 1/20 0.36
PPARA Q07869 1/20 0.36
GPR84 Q9NQS5 1/20 0.35
ABCB1 P08183 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C8 P10632 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2B6 P20813 1/20 0.34
CYP2C19 P33261 1/20 0.34
DNMT1 P26358 1/20 0.34
EEF2K O00418 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GLA P06280 1/20 0.34
RCE1 Q9Y256 1/20 0.34
MEN1 O00255 1/20 0.34
MAPT P10636 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 SCHEMBL4108766 1.00 ACHE (0.46) ACHECOL1A1P2RX7PPARGPPARA
Hydrochloric Acid SCHEMBL4109315 1.00 ACHE (0.46) ACHECOL1A1P2RX7PPARGPPARA
Hydrochloric Acid SCHEMBL4113694 0.91 ACHE (0.46) ACHEP2RX7PPARGPPARAGPR84
Hydrochloric Acid SCHEMBL4097795 0.91 ACHE (0.46) ACHEP2RX7PPARGPPARAGPR84
Hydrochloric Acid SCHEMBL4104174 0.91 ACHE (0.46) ACHEP2RX7PPARGPPARAGPR84
Hydrochloric Acid SCHEMBL4110993 0.90 ACHE (0.45) ACHECOL1A1P2RX7PPARGPPARA
SCHEMBL4770542 0.90 ACHE (0.46) ACHEP2RX7PPARGPPARAGPR84
SCHEMBL4770194 0.90 ACHE (0.46) ACHEP2RX7PPARGPPARAGPR84
Hydrochloric Acid SCHEMBL4105804 0.90 ACHE (0.46) ACHEP2RX7ABCB1KDM4E
Hydrochloric Acid SCHEMBL4101980 0.89 ACHE (0.44) ACHECOL1A1P2RX7PPARGPPARA

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-20090221829-A1 3,4-Dihydroisoquinolinium Salt Derivatives HANWHA CHEMICAL CORPORATION (KR) 2009-09-03 US disclosed
EP-1896419-A1 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES HANWHA CHEMICAL CORPORATION (KR) 2008-03-12 EP disclosed
WO-2006129978-A1 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES HANWHA CHEMICAL CORPORATION (KR) 2006-12-07 WO 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 984/4885COL1A1 4702/4885P2RX7 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.