Hydrochloric Acid

Hydrochloric Acid

SCHEMBL19409802

ClC(Cl)(Cl)[Fe+2].ClC(Cl)(Cl)c1ccccc1.[Cl-].[Cl-]

nearest known ligand 0.78

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 20)

geneUniProtsupporting neighboursconfidence
CHRM2 known ✓ P08172 1/20 0.35
CHRM1 known ✓ P11229 1/20 0.35
CHRM3 known ✓ P20309 1/20 0.35
ACHE known ✓ P22303 1/20 0.35
SLC6A2 known ✓ P23975 1/20 0.35
TACR1 known ✓ P25103 1/20 0.35
PTAFR known ✓ P25105 1/20 0.35
SLC6A3 known ✓ Q01959 1/20 0.35
TSHR P16473 5/20 0.78
CYP1A2 P05177 2/20 0.42
MAPK1 P28482 2/20 0.40
KCNN4 O15554 7/20 0.39
ALDH1A1 P00352 2/20 0.39
CYP11B1 P15538 1/20 0.35
CYP11B2 P19099 1/20 0.35
LMNA P02545 2/20 0.35
KCNA3 P22001 2/20 0.35
ALOX15 P16050 2/20 0.35
MEN1 O00255 1/20 0.35
SLC22A1 O15245 1/20 0.35

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 SCHEMBL28846684 0.88 TSHR (0.88) TSHRCYP1A2MAPK1KCNN4ALDH1A1
SCHEMBL522316 0.88 TSHR (1.00) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Hydrochloric Acid SCHEMBL27351108 0.85 TSHR (0.93) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Fluoride SCHEMBL28084339 0.85 TSHR (0.93) TSHRCYP1A2MAPK1KCNN4ALDH1A1
SCHEMBL30740351 0.85 TSHR (0.93) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Hydrochloric Acid SCHEMBL28581636 0.85 TSHR (0.93) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Ethane SCHEMBL28666542 0.82 TSHR (0.88) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Methylene Chloride SCHEMBL28935108 0.80 TSHR (0.82) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Methyl Alcohol SCHEMBL28788630 0.80 TSHR (0.82) TSHRCYP1A2MAPK1KCNN4ALDH1A1
Biphenyl SCHEMBL28542053 0.80 TSHR (0.82) TSHRCYP1A2MAPK1KCNN4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10196340-B2 Clean process for preparing chloroformyl-substituted benzene FININGS CO. LTD. (CN) 2019-02-05 US disclosed
US-20170283360-A1 CLEAN PROCESS FOR PREPARING CHLOROFORMYL-SUBSTITUTED BENZENE FININGS CO. LTD. (CN) 2017-10-05 US disclosed