Hydrochloric Acid

Hydrochloric Acid

SCHEMBL5611348

CCc1ccccc1C1=C2c3ccccc3C1[Zr+2]C1C(c3ccccc3CC)=C(c3ccccc31)[Si]2(C)C.[Cl-].[Cl-]

nearest known ligand 0.32

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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 8)

geneUniProtsupporting neighboursconfidence
ACHE known ✓ P22303 1/20 0.30
MAPK1 P28482 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
BCHE P06276 1/20 0.30
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 1/20 0.30
CSNK2A3 Q8NEV1 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
Hydrochloric Acid SCHEMBL4062480 0.78 BCHE (0.30) BCHEACHE
Hydrochloric Acid SCHEMBL6457215 0.77 HTR6 (0.33)
Hydrochloric Acid SCHEMBL7601225 0.77 ALDH1A1 (0.33) MAPK1NPSR1BCHEACHE
Hydrochloric Acid SCHEMBL8414418 0.73 GPR3 (0.31)
Hydrochloric Acid SCHEMBL7193390 0.71 CYP1A2 (0.37)
Bromide SCHEMBL7943471 0.71 GPR3 (0.31)
Hydrochloric Acid SCHEMBL4056251 0.71 GABRA1 (0.31)
Hydrochloric Acid SCHEMBL4323900 0.69 JAK2 (0.31)
Hydrochloric Acid SCHEMBL4313985 0.69
SCHEMBL6256373 0.69 CYP2D6 (0.37) MAPK1NPSR1CSNK2A2CSNK2BCSNK2A1

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
US-20070149386-A1 Catalyst system for olefin polymerization EQUISTAR CHEMICALS, LP 2007-06-28 US disclosed