Hydrochloric Acid

SCHEMBL7675400

CCCCC1(CCCC)[C@H](O)[C@H](c2cccc(NC(=O)C[N+](CC)(CC)CC)c2)c2cc(N(C)C)ccc2S(=O)(=O)N1C.[Cl-]

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

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
▸	SLC10A2 known ✓	Q12908	20/20	1.00

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
SCHEMBL7852691	0.87	SLC10A2 (1.00)	SLC10A2
Trifluoroacetic Acid SCHEMBL7843331	0.87	SLC10A2 (0.90)	SLC10A2
SCHEMBL7853297	0.81	SLC10A2 (1.00)	SLC10A2
SCHEMBL7852701	0.80	SLC10A2 (0.86)	SLC10A2
SCHEMBL7849977	0.79	SLC10A2 (1.00)	SLC10A2
SCHEMBL7850415	0.78	SLC10A2 (1.00)	SLC10A2
SCHEMBL7853684	0.74	SLC10A2 (1.00)	SLC10A2
Trifluoroacetic Acid SCHEMBL2568522	0.72	SLC10A2 (0.89)	SLC10A2
Trifluoroacetic Acid SCHEMBL2568520	0.72	SLC10A2 (0.89)	SLC10A2
Trifluoroacetic Acid SCHEMBL2568521	0.72	SLC10A2 (0.89)	SLC10A2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

Patent	Title	Assignee	Published	Priority	Filing	Country	Status
JP-2002536440-A	—	—	2002-10-29	—	—	JP	claimed
EP-1155007-A2	1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES	G.D. Searle LLC (US)	2001-11-21	—	—	EP	claimed
WO-2000047568-A2	1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES	G.D. SEARLE LLC (US)	2000-08-17	—	—	WO	claimed