Hydrochloric Acid

Hydrochloric Acid

SCHEMBL4097034

COc1cc2c(cc1OC)C(c1ccccc1F)=[N+](Cc1c(F)cccc1F)CC2.[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 20)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 6/20 0.40
RAD52 P43351 3/20 0.38
PKM P14618 1/20 0.38
KDM4E B2RXH2 3/20 0.37
CYP3A4 P08684 2/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
EP300 Q09472 2/20 0.37
BCHE P06276 1/20 0.37
PDE4A P27815 2/20 0.36
GPR84 Q9NQS5 2/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM1A O60341 1/20 0.35
LMNA P02545 1/20 0.35
CYP2D6 P10635 1/20 0.35
HIF1A Q16665 1/20 0.35
P2RX7 Q99572 2/20 0.35
GLA P06280 1/20 0.35
RCE1 Q9Y256 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
Hydrochloric Acid SCHEMBL4113907 0.93 P2RX7 (0.42) ACHERAD52PKMKDM4ECYP3A4
Hydrochloric Acid SCHEMBL4098686 0.89 ACHE (0.44) ACHERAD52PKMKDM4ECYP3A4
SCHEMBL4828302 0.87 ACHE (0.45) ACHERAD52PKMKDM4ECYP3A4
Hydrochloric Acid SCHEMBL4113587 0.86 ACHE (0.42) ACHERAD52PKMKDM4ECYP3A4
Hydrochloric Acid SCHEMBL4096507 0.85 ACHE (0.42) ACHERAD52PKMKDM4ECYP3A4
Hydrochloric Acid SCHEMBL4103757 0.84 ACHE (0.42) ACHERAD52PKMKDM4ECYP3A4
SCHEMBL4772235 0.83 ACHE (0.43) ACHERAD52PKMKDM4ECYP3A4
Hydrochloric Acid SCHEMBL4096533 0.83 COL1A1 (0.44) ACHERAD52KDM4ECYP3A4MAPT
Hydrochloric Acid SCHEMBL4108509 0.83 P2RX7 (0.39) ACHERAD52KDM4ECYP3A4MAPT
Hydrochloric Acid SCHEMBL4098447 0.81 ACHE (0.41) ACHERAD52KDM4ECYP3A4MAPT

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 984/4885RAD52 3111/4885PKM 3309/4885

“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.