Hydrochloric Acid

Hydrochloric Acid

SCHEMBL7675603

Cn1cc[n+](CCNc2cc3c(cc2OCCO)OCO3)c1.[Cl-]

nearest known ligand 0.34

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
KCNH2 Q12809 2/20 0.34
TMEM97 Q5BJF2 2/20 0.34
SIGMAR1 Q99720 2/20 0.34
EDNRB P24530 1/20 0.34
EDNRA P25101 1/20 0.34
TSHR P16473 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL7803210 0.99 KCNH2 (0.35) KCNH2TMEM97SIGMAR1EDNRBEDNRA
Hydrochloric Acid SCHEMBL7672524 0.89 KMT2A (0.33) TDP1
SCHEMBL7811774 0.87 KMT2A (0.33) TDP1
Hydrochloric Acid SCHEMBL7677754 0.86 LMNA (0.34) TDP1
SCHEMBL7809580 0.85 LMNA (0.35) KCNH2TDP1
Hydrochloric Acid SCHEMBL7672516 0.82 KDM4E (0.32) TDP1
SCHEMBL7803189 0.80 KDM4E (0.33) TSHRTDP1
Hydrochloric Acid SCHEMBL5481941 0.79 KDM4E (0.30) TDP1
Hydrochloric Acid SCHEMBL7679186 0.78
SCHEMBL5242262 0.78 KDM4E (0.31) TDP1

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-6497730-B1 TO DYE KERATIN FIBRES, AND IN PARTICULAR HUMAN HAIR, WITH DYE COMPOSITIONS CONTAINING OXIDATION DYE PRECURSORS L'OREAL S.A. (FR) 2002-12-24 US claimed
EP-1066281-B1 CATIONIC METHYLENEDIOXY BENZENES, THEIR USE FOR OXIDATION DYEING OF KERATIN FIBRES, DYEING COMPOSITIONS AND METHODS OREAL (FR) 2001-10-31 EP claimed
US-6497730-B1 TO DYE KERATIN FIBRES, AND IN PARTICULAR HUMAN HAIR, WITH DYE COMPOSITIONS CONTAINING OXIDATION DYE PRECURSORS L'OREAL S.A. (FR) 2002-12-24 US disclosed