Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28912715

C=CC(=O)OCC[N+](C)(C)C(C)CC.[Cl-]

nearest known ligand 0.47

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
▸ CHRM1 known ✓ P11229 4/20 0.34
▸ CHRM3 known ✓ P20309 4/20 0.34
▸ CHRM2 known ✓ P08172 3/20 0.33
▸ ACHE known ✓ P22303 1/20 0.33
▸ TSHR P16473 8/20 0.47
▸ HPGD P15428 1/20 0.47
▸ ALDH1A1 P00352 4/20 0.43
▸ TP53 P04637 3/20 0.43
▸ HIF1A Q16665 3/20 0.43
▸ CYP3A4 P08684 2/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ THRB P10828 2/20 0.41
▸ CHRM5 P08912 4/20 0.34
▸ MAPT P10636 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ CHRM4 P08173 3/20 0.33
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ LMNA P02545 2/20 0.32
▸ APEX1 P27695 1/20 0.32

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 SCHEMBL28613326 0.85 TSHR (0.48) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL28109247 0.84 TSHR (0.49) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL31510117 0.83 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
Iodide SCHEMBL31281208 0.81 TSHR (0.48) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL31280690 0.81 TSHR (0.48) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL28248448 0.80 TSHR (0.51) TSHRHPGDALDH1A1TP53HIF1A
Bromide SCHEMBL28187197 0.80 TSHR (0.51) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28148568 0.79 TSHR (0.43) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL9066024 0.79 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
Hydrochloric Acid SCHEMBL28338986 0.77 TSHR (0.47) TSHRHPGDALDH1A1TP53HIF1A

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
CN-110229381-B Fluorine-silicon-containing poly (methyl) acrylate modified montmorillonite and preparation method and application thereof 中科广化(重庆)新材料研究院有限公司 2021-05-07 — — CN disclosed
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