Tetrylammonium

Tetrylammonium

SCHEMBL276752

CCOP(=O)(Cc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1)OCC.CC[N+](CC)(CC)CC.[OH-]

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ

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 20)

geneUniProtsupporting neighboursconfidence
HMGCR P04035 3/20 0.56
NR1I2 O75469 1/20 0.49
GAA P10253 5/20 0.48
KMT2A Q03164 4/20 0.48
MEN1 O00255 3/20 0.48
ALDH1A1 P00352 5/20 0.40
MAPT P10636 4/20 0.40
TSHR P16473 3/20 0.40
MAPK1 P28482 3/20 0.40
CYP1A2 P05177 2/20 0.40
CYP3A4 P08684 2/20 0.40
BLM P54132 2/20 0.40
ATM Q13315 2/20 0.40
HIF1A Q16665 2/20 0.40
NPSR1 Q6W5P4 2/20 0.40
USP2 O75604 1/20 0.40
CYP2D6 P10635 1/20 0.40
LMNA P02545 3/20 0.40
RECQL P46063 1/20 0.39
ALOX15 P16050 2/20 0.39

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
SCHEMBL39364 0.93 HMGCR (0.62) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL564169 0.91 HMGCR (0.61) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL28615117 0.91 HMGCR (0.61) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL5428580 0.91 HMGCR (0.61) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL562987 0.91 HMGCR (0.61) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL859105 0.87 HMGCR (0.59) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL10992943 0.86 HMGCR (0.58) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL11593736 0.83 HMGCR (0.52) HMGCRNR1I2GAAKMT2AMEN1
Tetrylammonium SCHEMBL27764037 0.82 HMGCR (0.54) HMGCRNR1I2GAAKMT2AMEN1
SCHEMBL10985155 0.81 HMGCR (0.52) HMGCRNR1I2GAAKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8133955-B2 Aromatic polyester resin composition and process for production thereof KUREHA CORPORATION (JP) 2012-03-13 US disclosed
US-20100093948-A1 AROMATIC POLYESTER RESIN MOLDINGS AND PROCESS FOR PRODUCTION THEREOF KUREHA CORPORATION (JP) 2010-04-15 US disclosed
US-20100063219-A1 AROMATIC POLYESTER RESIN COMPOSITION AND PROCESS FOR PRODUCTION THEREOF KUREHA CORPORATION (JP) 2010-03-11 US disclosed
EP-2123698-A1 AROMATIC POLYESTER RESIN MOLDINGS AND PROCESS FOR PRODUCTION THEREOF Kureha Corporation (JP) 2009-11-25 EP disclosed
EP-2123714-A1 AROMATIC POLYESTER RESIN COMPOSITION AND PROCESS FOR PRODUCTION THEREOF Kureha Corporation (JP) 2009-11-25 EP disclosed