Hydrochloric Acid

Hydrochloric Acid

SCHEMBL2012582

Cc1cccc(Cn2cc[n+](C)c2)c1.[Cl-]

nearest known ligand 0.55

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 13)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 2/20 0.55
CYP11B2 P19099 2/20 0.55
PON1 P27169 2/20 0.44
ALDH1A1 P00352 4/20 0.43
POLB P06746 2/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAPT P10636 3/20 0.41
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.40
TAAR1 Q96RJ0 1/20 0.39
IDO1 P14902 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
SCHEMBL20138573 0.98 CYP11B1 (0.53) CYP11B1CYP11B2PON1ALDH1A1POLB
Water SCHEMBL18260003 0.97 CYP11B1 (0.51) CYP11B1CYP11B2PON1ALDH1A1POLB
SCHEMBL6890190 0.82 PON1 (0.47) CYP11B1CYP11B2PON1MEN1KMT2A
SCHEMBL18259778 0.82 CYP11B1 (0.47) CYP11B1CYP11B2PON1ALDH1A1MEN1
Hydrochloric Acid SCHEMBL383000 0.82 PON1 (0.52) CYP11B1CYP11B2PON1POLBMEN1
Hydrochloric Acid SCHEMBL2011318 0.81 LPO (0.55) ALDH1A1POLBMEN1KMT2AMAPT
Water SCHEMBL18260008 0.80 CYP11B1 (0.46) CYP11B1CYP11B2PON1ALDH1A1MEN1
SCHEMBL667065 0.80 PON1 (0.50) CYP11B1CYP11B2PON1POLBMEN1
SCHEMBL1011073 0.79 LPO (0.56) ALDH1A1MEN1KMT2AMAPTTP53
Bromide SCHEMBL1179197 0.78 PON1 (0.49) CYP11B1CYP11B2PON1POLBMEN1

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
EP-2475677-B1 PROCESSES FOR PRODUCING SILK DOPE COMMW SCIENT IND RES ORG (AU) 2018-08-01 EP disclosed
US-8674077-B2 Processes for producing silk dope COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2014-03-18 US disclosed
US-20120302734-A1 Processes for Producing Silk Dope COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2012-11-29 US disclosed
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
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