Hydrochloric Acid

SCHEMBL6661681

CC(C)(C)c1ccc2c(c1)-c1cc(C(C)(C)C)cc(C3=CC([Si](C)(C)C)=CC3)c1C2[Zr+2]=C(c1ccccc1)c1ccccc1.[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 1)

	gene	UniProt	supporting neighbours	confidence
▸	CYP19A1	P11511	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 SCHEMBL6662492	0.88	—	—
Hydrochloric Acid SCHEMBL6868845	0.82	—	—
SCHEMBL6925827	0.82	CYP19A1 (0.31)	CYP19A1
SCHEMBL6658671	0.78	CYP19A1 (0.32)	CYP19A1
SCHEMBL6656100	0.77	CYP19A1 (0.32)	CYP19A1
SCHEMBL6920791	0.76	—	—
Hydrochloric Acid SCHEMBL2276418	0.75	—	—
SCHEMBL3157010	0.73	CYP19A1 (0.33)	CYP19A1
Hydrochloric Acid SCHEMBL675080	0.72	CYP19A1 (0.32)	CYP19A1
Hydrochloric Acid SCHEMBL9065393	0.71	—	—

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-1169356-B1	POLYOLEFIN PRODUCTION	ATOFINA RES (BE)	2004-07-14	—	—	EP	disclosed