Hydrochloric Acid

SCHEMBL6013019

Cc1cc2c(cc1C(C)(C)C)-c1cc(C(C)(C)C)c(C)cc1C2/[Zr+2](=C/c1cccc(C(F)(F)F)c1)C1=CC=CC1.[Cl-].[Cl-]

nearest known ligand 0.33

Known targets — ChEMBL curated mechanism

ACHE BDKRB2 CHRM1 CHRM2 CHRM3 CHRNA1 CHRNB1 CHRND CHRNE CHRNG GUCY1A1 GUCY1A2 GUCY1B1 GUCY1B2 NAMPT PTAFR SLC10A2 SLC6A2 SLC6A3 TACR1 dacA dacB dacC ftsI mrcA mrcB mrdA

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 2)

	gene	UniProt	supporting neighbours	confidence
▸	NFE2L2	Q16236	1/20	0.33

▸	PTGES2	Q9H7Z7	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.

Compound	similarity	top predicted	shared targets
Hydrochloric Acid SCHEMBL4952225	0.83	—	—
Hydrochloric Acid SCHEMBL18092776	0.81	—	—
Hydrochloric Acid SCHEMBL6047490	0.79	CYP1A2 (0.31)	—
Hydrochloric Acid SCHEMBL399658	0.79	TAS1R3 (0.31)	—
Hydrochloric Acid SCHEMBL1479960	0.78	—	—
Hydrochloric Acid SCHEMBL400909	0.77	GAA (0.32)	—
Biphenyl SCHEMBL400845	0.76	—	—
Hydrochloric Acid SCHEMBL6013131	0.76	—	—
Hydrochloric Acid SCHEMBL400905	0.76	CCR2 (0.33)	—
Hydrochloric Acid SCHEMBL14776024	0.75	—	—

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.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
US-20060116303-A1	decene-ethylene copolymer, zirconium, titanium or hafnium fluorene-containing complexes, organometallics; improved high thermal oxidation stability, viscosity index, low-temperature viscosity properties and shear stability	MITSUI CHEMICALS, INC. (JP)	2006-06-01	—	—	US	disclosed