Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL796640

CCCC[N+](CCCC)(CCCC)CCCC.Cc1ccc2cc3cc4cc5cccc(O)c5c(O)c4c(O)c3c(O)c2c1O

nearest known ligand 0.49

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.49
ALDH1A1 P00352 3/20 0.49
KMT2A Q03164 3/20 0.49
DNMT1 P26358 1/20 0.49
CACNA1B Q00975 1/20 0.49
APBA1 Q02410 1/20 0.49
MCL1 Q07820 1/20 0.49
APOBEC3G Q9HC16 1/20 0.49
MAOA P21397 1/20 0.34
TRPA1 O75762 1/20 0.33
MAPT P10636 2/20 0.32
HTT P42858 1/20 0.32
ATM Q13315 1/20 0.32
CNR1 P21554 2/20 0.31
CNR2 P34972 2/20 0.31
SLC22A1 O15245 1/20 0.31
KDM4E B2RXH2 1/20 0.31
INPPL1 O15357 1/20 0.31
NSD2 O96028 1/20 0.31
TP53 P04637 1/20 0.31

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
SCHEMBL796941 0.85 ALDH1A1 (0.68) MEN1ALDH1A1KMT2ADNMT1CACNA1B
SCHEMBL6545340 0.73 ALDH1A1 (0.56) MEN1ALDH1A1KMT2ADNMT1CACNA1B
SCHEMBL3320154 0.73 ALDH1A1 (0.91) MEN1ALDH1A1KMT2ADNMT1CACNA1B
SCHEMBL3198 0.70 ALDH1A1 (1.00) MEN1ALDH1A1KMT2ADNMT1CACNA1B
SCHEMBL29906204 0.68 ALDH1A1 (0.70) MEN1ALDH1A1KMT2ADNMT1CACNA1B
SCHEMBL5858623 0.68 ALDH1A1 (0.70) MEN1ALDH1A1KMT2ADNMT1CACNA1B
Tetrabuthylammonium SCHEMBL796639 0.67 SLC22A1 (0.33) MEN1KMT2ASLC22A1
SCHEMBL6561939 0.67 MCL1 (0.49) MEN1ALDH1A1KMT2ADNMT1CACNA1B
Tetrabuthylammonium SCHEMBL3296432 0.65 SLC22A1 (0.60) MEN1ALDH1A1KMT2AHTTSLC22A1
SCHEMBL6545416 0.64 ELANE (0.50) MEN1ALDH1A1KMT2ADNMT1CACNA1B

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-1262469-B1 POLYACENE DERIVATIVES AND PRODUCTION THEREOF JAPAN SCIENCE & TECH AGENCY (JP) 2012-01-11 EP disclosed