Hydrochloric Acid

SCHEMBL3284261

Cc1ccc2c(c1)C([Zr+2](C1=CC(C(C)(C)C)=CC1C(C)C)=C(c1ccc(C(F)(F)F)cc1)c1ccc(C(F)(F)F)cc1)c1cc(C)ccc1-2.[Cl-].[Cl-]

nearest known ligand 0.31

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
▸	CYP1A1	P04798	1/20	0.31

▸	CYP1B1	Q16678	1/20	0.31

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 SCHEMBL3278801	0.92	—	—
Hydrochloric Acid SCHEMBL3268778	0.92	—	—
Hydrochloric Acid SCHEMBL3277978	0.90	MEN1 (0.32)	—
Hydrochloric Acid SCHEMBL3276197	0.89	—	—
Hydrochloric Acid SCHEMBL3281392	0.89	—	—
Hydrochloric Acid SCHEMBL3283507	0.88	—	—
Hydrochloric Acid SCHEMBL3278866	0.87	—	—
Hydrochloric Acid SCHEMBL3277804	0.87	KIF11 (0.32)	—
Hydrochloric Acid SCHEMBL3276753	0.87	—	—
Hydrochloric Acid SCHEMBL1234479	0.85	—	—

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
EP-1803742-B1	PROCESS FOR PRODUCING PROPYLENE POLYMER	MITSUI CHEMICALS INC (JP)	2010-06-23	—	—	EP	disclosed