Hydrochloric Acid

Hydrochloric Acid

SCHEMBL28034977

CCCCCc1ccc(-c2cccc3c2C=C(CC)C3[Zr+2])cc1.[Cl-].[Cl-]

nearest known ligand 0.36

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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
SLC6A2 known ✓ P23975 3/20 0.34
SLC6A3 known ✓ Q01959 2/20 0.34
CHRM2 known ✓ P08172 1/20 0.34
CHRM1 known ✓ P11229 1/20 0.34
CHRM3 known ✓ P20309 1/20 0.34
ACHE known ✓ P22303 1/20 0.34
HSD11B1 P28845 3/20 0.36
RARB P10826 7/20 0.35
HSD17B10 Q99714 2/20 0.35
TSHR P16473 1/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
RARA P10276 1/20 0.35
MAPT P10636 1/20 0.35
MTOR P42345 1/20 0.35
KMT2A Q03164 1/20 0.35
SLC6A4 P31645 3/20 0.34
ESR1 P03372 2/20 0.34
ADRA2A P08913 2/20 0.34
ADORA3 P0DMS8 2/20 0.34

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 SCHEMBL27489635 0.99 HSD17B10 (0.37) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27489633 0.96 HSD11B1 (0.35) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27689381 0.93 HSD17B10 (0.38) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27446170 0.92 HSD17B10 (0.37) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27462651 0.92 HSD17B10 (0.37) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27689398 0.92 HSD17B10 (0.37) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27463585 0.91 EDNRB (0.32)
Hydrochloric Acid SCHEMBL27464021 0.90 HSD11B1 (0.35) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27670344 0.89 HSD17B10 (0.35) HSD11B1RARBHSD17B10TSHRALDH1A1
Hydrochloric Acid SCHEMBL27689388 0.89 SLC6A2 (0.33) HSD11B1RARBHSD17B10TSHRALDH1A1

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-103012623-B Metalloscene catalyst, its synthesis and purposes in olefin polymerization NOVOLEN TECH HOLDINGS CV (DE) 2015-09-16 CN disclosed