Dyclonine

Dyclonine

SCHEMBL8662373

CCCCOc1ccc(C(=O)CCN2CCCCC2)cc1.O=S(=O)(O)O

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

SCN10ASCN11ASCN1ASCN2ASCN3ASCN4ASCN5ASCN7ASCN8ASCN9A

The experimentally established mechanism targets of Dyclonine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 9/20 0.90
ALDH1A1 P00352 8/20 0.90
LMNA P02545 7/20 0.90
HRH2 P25021 4/20 0.90
HRH1 P35367 4/20 0.90
HRH3 Q9Y5N1 2/20 0.90
CYP1A2 P05177 1/20 0.90
CHRM2 P08172 1/20 0.90
CHRM4 P08173 1/20 0.90
CHRM5 P08912 1/20 0.90
CYP2D6 P10635 1/20 0.90
CYP2C9 P11712 1/20 0.90
ADRA2C P18825 1/20 0.90
DRD4 P21917 1/20 0.90
ACHE P22303 1/20 0.90
SLC6A2 P23975 1/20 0.90
HTR2A P28223 1/20 0.90
ADRA1A P35348 1/20 0.90
SLC6A3 Q01959 1/20 0.90
PDE4D Q08499 1/20 0.90

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
SCHEMBL29766083 0.95 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
Dyclonine SCHEMBL25773 0.95 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
Dyclonine SCHEMBL317219 0.94 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
Dyclonine SCHEMBL1649948 0.93 THRB (0.95) THRBALDH1A1LMNAHRH2HRH1
SCHEMBL11231907 0.91 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
SCHEMBL9320014 0.91 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
SCHEMBL9319585 0.91 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
SCHEMBL9320006 0.91 THRB (1.00) THRBALDH1A1LMNAHRH2HRH1
Hydrochloric Acid SCHEMBL11234596 0.90 THRB (0.98) THRBALDH1A1LMNAHRH2HRH1
SCHEMBL29378842 0.90 ALDH1A1 (0.97) THRBALDH1A1LMNAHRH2HRH1

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
EP-0872248-A2 Pharmaceutical vehicles for reducing transdermal flux Access Pharmaceuticals, Inc. (US) 1998-10-21 EP claimed