Hydrochloric Acid

Hydrochloric Acid

SCHEMBL11180874

Clc1ccc(C[N+]2(CCOc3ccc4c(c3)oc3cc(Cl)ccc34)CCCCC2)c(Cl)c1.[Cl-]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

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 9)

geneUniProtsupporting neighboursconfidence
▸ ACHE known ✓ P22303 1/20 0.36
▸ MAOB P27338 11/20 0.41
▸ HRH3 Q9Y5N1 11/20 0.41
▸ BCHE P06276 1/20 0.36
▸ PRKDC P78527 1/20 0.35
▸ SLC26A4 O43511 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ AHR P35869 1/20 0.34
▸ XDH P47989 1/20 0.34

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 SCHEMBL11092182 0.87 MAOB (0.42) MAOBHRH3BCHEACHEPRKDC
SCHEMBL11288733 0.86 MAOB (0.42) MAOBHRH3BCHEACHEPRKDC
Hydrochloric Acid SCHEMBL11094001 0.85 MAOB (0.41) MAOBHRH3BCHEACHEAHR
Hydrochloric Acid SCHEMBL11181042 0.85 AHR (0.38) MAOBHRH3BCHEACHEAHR
Hydrochloric Acid SCHEMBL11096484 0.84 ACHE (0.41) MAOBHRH3BCHEACHEAHR
Bromide SCHEMBL11090702 0.82 MAOB (0.39) MAOBHRH3BCHEACHEPRKDC
Bromide SCHEMBL11089271 0.82 MAOB (0.40) MAOBHRH3ACHE
Hydrochloric Acid SCHEMBL11094609 0.80 MAOB (0.40) MAOBHRH3BCHEACHEPRKDC
Bromide SCHEMBL11097385 0.80 MAOB (0.41) MAOBHRH3BCHEACHEPRKDC
Bromide SCHEMBL11180051 0.79 MAOB (0.38) MAOBHRH3BCHEACHEPRKDC

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-4376776-A Dibenzofuran derivatives and their use for controlling fungi BASF AKTIENGESELLSCHAFT (DE) 1983-03-15 — — US claimed
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