Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11054825

CC=CC(=O)NCCC[N+](C)(C)CC.[Cl-]

nearest known ligand 0.42

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 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
ATM Q13315 1/20 0.42
BBOX1 O75936 3/20 0.41
CBLB Q13191 5/20 0.40
APEX1 P27695 1/20 0.39
ALDH1A1 P00352 1/20 0.37
ZDHHC20 Q5W0Z9 2/20 0.35
ZDHHC2 Q9UIJ5 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
DNM1 Q05193 2/20 0.34
HTT P42858 1/20 0.34
EGFR P00533 1/20 0.34
HSP90AA1 P07900 1/20 0.33
RAD52 P43351 1/20 0.33
TAAR1 Q96RJ0 1/20 0.33

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 SCHEMBL7100993 0.86 ZDHHC20 (0.46) KMT2AATMCBLBZDHHC20ZDHHC2
Hydrochloric Acid SCHEMBL22687484 0.85 APEX1 (0.40) KMT2AATMCBLBAPEX1ALDH1A1
Hydrochloric Acid SCHEMBL233973 0.84 APEX1 (0.41) KMT2AATMBBOX1CBLBAPEX1
SCHEMBL4659384 0.84 ZDHHC20 (0.47) CBLBZDHHC20ZDHHC2DNM1HTT
SCHEMBL1628096 0.82 APEX1 (0.42) KMT2AATMBBOX1CBLBAPEX1
SCHEMBL25544701 0.82 APEX1 (0.42) KMT2AATMBBOX1CBLBAPEX1
Hydrochloric Acid SCHEMBL562283 0.81 ZDHHC20 (0.56) KMT2AATMBBOX1CBLBALDH1A1
SCHEMBL25187770 0.80 CBLB (0.43) KMT2AATMBBOX1CBLBAPEX1
SCHEMBL475893 0.79 ZDHHC20 (0.58) KMT2AATMBBOX1CBLBALDH1A1
Hydrochloric Acid SCHEMBL10456825 0.79 LMNA (0.45) KMT2AATMCBLBAPEX1ALDH1A1

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-4454060-A Liquid detergent composition with a cationic foam stabilizing copolymer containing pendant quaternary nitrogen groups and pendant hydrophobic groups COLGATE-PALMOLIVE COMPANY (US) 1984-06-12 US disclosed