Hydrochloric Acid

Hydrochloric Acid

SCHEMBL8072773

CCCC(O)(S)C(=O)O.[Cl-].[Cl-].[Zn+2]

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 15)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
FFAR3 O14843 1/20 0.31
HDAC3 O15379 1/20 0.31
HDAC1 Q13547 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
GAA P10253 1/20 0.31
ALOX12 P18054 1/20 0.31
CYP2C19 P33261 1/20 0.31
MEN1 O00255 1/20 0.30
CYP1A2 P05177 1/20 0.30
THRB P10828 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL459604 0.95
SCHEMBL8072767 0.93 FDPS (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
Ammonia Solution, Strong SCHEMBL28340659 0.93 FDPS (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
SCHEMBL6624472 0.93 FDPS (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
SCHEMBL7122285 0.81 AKR1B1 (0.37) ALDH1A1TSHRMEN1KMT2A
Hydrochloric Acid SCHEMBL8074880 0.79 FFAR3 (0.33) FDPSTSHRFFAR3HDAC3HDAC1
SCHEMBL18095169 0.74
SCHEMBL8065098 0.73
SCHEMBL14762676 0.73 FFAR3 (0.36) FDPSALDH1A1TSHRFFAR3HDAC3
SCHEMBL11061354 0.72 FFAR3 (0.35) FDPSALDH1A1TSHRFFAR3HDAC3

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
EP-0840723-B1 Salts of aliphatic alpha-hydroxy carboxylic acids and their preparation ZINPRO CORP (US) 2000-08-16 EP disclosed