Tetrylammonium

Tetrylammonium

SCHEMBL11155692

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nearest known ligand 0.53

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Known targets — ChEMBL curated mechanism

ACEADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB1ADRB2ATP4AATP4BAXLBTKCACNA1CCACNA1DCACNA1FCACNA1SCCR5CHRM2CHRM3CPT1BCPT2DPP4DRD1DRD2EGFRERBB2ERBB4FLT3HRH1HRH3HTR1AHTR2AHTR2BHTR2CHTR4JAK1JAK2JAK3KCNH2KMT2AMAP2K1MAP2K2MEN1MLNRMPLMTORPPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PLK4PPARGRENS1PR1SLC6A2SLC6A3SLC6A4SMOTYK2atpAatpBatpCatpDatpEatpFatpFHatpGpol

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

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 4/20 0.44
TSHR P16473 1/20 0.42
NFKB1 P19838 1/20 0.42
KCNA1 Q09470 1/20 0.42
KDM4E B2RXH2 1/20 0.40
PMP22 Q01453 1/20 0.40
ATM Q13315 1/20 0.40
CA1 P00915 1/20 0.36
CA9 Q16790 1/20 0.36
FFAR3 O14843 2/20 0.32
HDAC3 O15379 2/20 0.32
HDAC1 Q13547 2/20 0.32
HDAC2 Q92769 2/20 0.32
HDAC8 Q9BY41 2/20 0.32

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
Tetrylammonium SCHEMBL3864261 1.00 BBOX1 (0.44) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2452722 0.97 BBOX1 (0.46) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2353697 0.97 BBOX1 (0.46) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2348762 0.97 BBOX1 (0.46) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2346208 0.95 BBOX1 (0.44) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2351931 0.95 BBOX1 (0.44) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2346200 0.95 BBOX1 (0.44) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2452720 0.88 TSHR (0.41) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2351488 0.88 TSHR (0.41) BBOX1TSHRNFKB1KCNA1KDM4E
Tetrylammonium SCHEMBL2349569 0.88 TSHR (0.41) BBOX1TSHRNFKB1KCNA1KDM4E

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-4377692-A ELECTROLYTE SOLUTES SPRAGUE ELECTRIC COMPANY (US) 1983-03-22 US disclosed