Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2008134

COc1cccc(C[n+]2ccccc2C)c1.[Cl-]

nearest known ligand 0.49

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 16)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 2/20 0.49
CHRM2 known ✓ P08172 1/20 0.43
CHRM1 known ✓ P11229 1/20 0.43
CHRM3 known ✓ P20309 1/20 0.43
NPC1 O15118 1/20 0.49
RAB9A P51151 1/20 0.49
TAAR1 Q96RJ0 3/20 0.45
IDO1 P14902 2/20 0.45
AGXT P21549 2/20 0.45
KMT2A Q03164 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
MAOB P27338 2/20 0.44
SIGMAR1 Q99720 2/20 0.43
CMA1 P23946 1/20 0.42
AOC3 Q16853 1/20 0.41

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 SCHEMBL2005677 0.81 NPC1 (0.44) ACHENPC1RAB9ATAAR1IDO1
Hydrochloric Acid SCHEMBL637319 0.78 RAB9A (0.52) ACHENPC1RAB9AKMT2ACA1
SCHEMBL2469671 0.76 RAB9A (0.53) ACHENPC1RAB9AKMT2ACA1
Hydrochloric Acid SCHEMBL2170188 0.75 CYP3A4 (0.47) RAB9AKMT2A
SCHEMBL14237545 0.75 TAAR1 (0.44) ACHENPC1RAB9ATAAR1IDO1
Bromide SCHEMBL30982171 0.75 SMN1; SMN2 (0.57) ACHENPC1RAB9AKMT2ACA1
Bromide SCHEMBL504672 0.75 SMN1; SMN2 (0.57) ACHENPC1RAB9AKMT2ACA1
Hydrochloric Acid SCHEMBL11540455 0.73 CA1 (0.46) ACHENPC1RAB9ATAAR1IDO1
SCHEMBL16079011 0.70 RAB9A (0.43) ACHENPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL2008133 0.69 TAAR1 (0.56) TAAR1IDO1AGXTMAOBSIGMAR1

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8182557-B2 Pretreating lignocellulosic (woody biomass) by dissolving in ionic liquid comprising imidazolium or pyridinium salt to form a solution; precipitating with regenerating solvent (water); hydrolysis to form sugar and fermentation to form bioethanol; recycling through evaporation; environmentally friendly NORTH CAROLINA STATE UNIVERSITY (US) 2012-05-22 US disclosed
US-7959765-B2 Dissolving in liquid; pyrolysis NORTH CAROLINA STATE UNIVERSTIY (US) 2011-06-14 US disclosed
US-20080190013-A1 USE OF LIGNOCELLULOSICS SOLVATED IN IONIC LIQUIDS FOR PRODUCTION OF BIOFUELS NORTH CAROLINA STATE UNIVERSITY 2008-08-14 US disclosed
WO-2008098032-A2 USE OF LIGNOCELLULOSICS SOLVATED IN IONIC LIQUIDS FOR PRODUCTION OF BIOFUELS NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-14 WO disclosed
WO-2008098036-A1 PRODUCT PREPARATION AND RECOVERY FROM THERMOLYSIS OF LIGNOCELLULOSICS IN IONIC LIQUIDS NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-14 WO disclosed
WO-2008098037-A2 POLYMER DERIVATIVES AND COMPOSITES FROM THE DISSOLUTION OF LIGNOCELLULOSICS IN IONIC LIQUIDS NORTH CAROLINA STATE UNIVERSITY (US) 2008-08-14 WO disclosed
US-20080188636-A1 POLYMER DERIVATIVES AND COMPOSITES FROM THE DISSOLUTION OF LIGNOCELLULOSICS IN IONIC LIQUIDS NORTH CAROLINA STATE UNIVERSITY 2008-08-07 US disclosed
US-20080185112-A1 PRODUCT PREPARATION AND RECOVERY FROM THERMOLYSIS OF LIGNOCELLULOSICS IN IONIC LIQUIDS NORTH CAROLINA STATE UNIVERSITY 2008-08-07 US disclosed