Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8723502

CCCCCCCC[N+](C)(CCCCCCCC)CCCCCCCC.O=C(OCCCCCCCCOc1ccccc1[N+](=O)[O-])OB(O)c1ccccc1.[Cl-]

nearest known ligand 0.48

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 19)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 3/20 0.42
RAB9A P51151 3/20 0.41
NPC1 O15118 2/20 0.41
RECQL P46063 1/20 0.41
KDM4E B2RXH2 2/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
ALDH1A1 P00352 4/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
LMNA P02545 1/20 0.40
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
PLA2G4B P0C869 1/20 0.38
POLB P06746 1/20 0.38
KCNH2 Q12809 1/20 0.38
HTT P42858 1/20 0.38
MEN1 O00255 1/20 0.38
ESR1 P03372 1/20 0.38

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
SCHEMBL8725786 0.88 L3MBTL1 (0.53) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8721558 0.88 L3MBTL1 (0.53) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8722487 0.88 L3MBTL1 (0.53) L3MBTL1KMT2ARAB9ANPC1RECQL
Hydrochloric Acid SCHEMBL8723501 0.82 L3MBTL1 (0.48) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8725784 0.79 L3MBTL1 (0.54) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8721554 0.79 L3MBTL1 (0.54) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8722484 0.79 L3MBTL1 (0.54) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8721566 0.76 L3MBTL1 (0.44) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL8581954 0.75 NPC1 (0.72) L3MBTL1KMT2ARAB9ANPC1RECQL
SCHEMBL1123538 0.75 NPC1 (0.72) L3MBTL1KMT2ARAB9ANPC1RECQL

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-5800624-A LIPOPHILIC POLYMER, HYDROPHOBIC PLASTICIZER, QUATERNARY AMMONIUM OR PHOSPHONIUM CARRIER UNIVERSITY OF NOTRE DAME (US) 1998-09-01 US disclosed