Difenoximide

Difenoximide

SCHEMBL3137667

N#CC(CCN1CCC(C(=O)ON2C(=O)CCC2=O)(c2ccccc2)CC1)(c1ccccc1)c1ccccc1.[Cl-].[H+]

nearest known ligand 0.71

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA

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

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 9/20 0.71
OPRM1 P35372 1/20 0.68
CCR1 P32246 8/20 0.50
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46

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
Difenoximide SCHEMBL1818240 0.98 KCNA3 (0.73) KCNA3OPRM1CCR1RAB9ANPSR1
Difenoximide SCHEMBL121671 0.97 KCNA3 (0.72) KCNA3OPRM1CCR1RAB9ANPSR1
SCHEMBL11604250 0.85 KCNA3 (0.84) KCNA3OPRM1CCR1RAB9ANPSR1
Difenoxin SCHEMBL123801 0.81 KCNA3 (0.78) KCNA3OPRM1CCR1RAB9ANPSR1
Diphenoxylate SCHEMBL42940 0.81 OPRM1 (1.00) KCNA3OPRM1
Difenoxin SCHEMBL149008 0.81 KCNA3 (0.76) KCNA3OPRM1CCR1RAB9ANPSR1
Difenoxin SCHEMBL11604884 0.81 KCNA3 (0.76) KCNA3OPRM1CCR1RAB9ANPSR1
Diphenoxylate SCHEMBL42124 0.81 OPRM1 (0.98) KCNA3OPRM1
Diphenoxylate SCHEMBL20595320 0.81 OPRM1 (0.98) KCNA3OPRM1
Diphenoxylate SCHEMBL28385054 0.81 OPRM1 (0.98) KCNA3OPRM1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2151846-B1 High temperature thermal cutoff device THERM O DISC INC (US) 2013-10-09 EP disclosed
CN-101685733-A High-temperature thermal fuse device THERM O DISC INC 2010-03-31 CN disclosed
EP-2151846-A2 High temperature thermal cutoff device Therm-O-Disc Incorporated (US) 2010-02-10 EP disclosed