Tetrabuthylammonium

Tetrabuthylammonium

SCHEMBL7080332

CCCC[N+](CCCC)(CCCC)CCCC.CCCC[N+](CCCC)(CCCC)CCCC.O=P([O-])([O-])Oc1ccccc1

nearest known ligand 0.54

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.44
MLNR O43193 1/20 0.42
NR1I2 O75469 1/20 0.42
ESR1 P03372 1/20 0.42
NR3C1 P04150 1/20 0.42
PGR P06401 1/20 0.42
ADRB2 P07550 1/20 0.42
CHRM2 P08172 1/20 0.42
ADRB1 P08588 1/20 0.42
HTR1A P08908 1/20 0.42
ADRA2A P08913 1/20 0.42
ADORA3 P0DMS8 1/20 0.42
CHRM1 P11229 1/20 0.42
DRD2 P14416 1/20 0.42
ADRA2B P18089 1/20 0.42
ADRA2C P18825 1/20 0.42
CHRM3 P20309 1/20 0.42
MAOA P21397 1/20 0.42
CNR1 P21554 1/20 0.42
SLC6A2 P23975 1/20 0.42

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
Tetrabuthylammonium SCHEMBL7082907 0.90 L3MBTL1 (0.44) L3MBTL1MLNRNR1I2ESR1NR3C1
Tetrabuthylammonium SCHEMBL7080335 0.88 SRC (0.44) L3MBTL1MLNRNR1I2ESR1NR3C1
Phenyl Dihydrogen Phosphate SCHEMBL11362295 0.86 ESR1 (0.49) MLNRNR1I2ESR1NR3C1PGR
Phenyl Dihydrogen Phosphate SCHEMBL11374481 0.86 ESR1 (0.49) MLNRNR1I2ESR1NR3C1PGR
Phenyl Dihydrogen Phosphate SCHEMBL5586429 0.83 L3MBTL1 (0.49) L3MBTL1HTTCA12CA1CA2
Tetrabuthylammonium SCHEMBL26599520 0.80 CA1 (0.49) DRD2DRD3ALDH1A1LMNACYP3A4
SCHEMBL11359462 0.79 L3MBTL1 (0.37) L3MBTL1CA12CA1CA2CA4
Phenyl Dihydrogen Phosphate SCHEMBL17782230 0.78 SRC (0.58) L3MBTL1ALDH1A1LMNAHTTCA12
Phenyl Dihydrogen Phosphate SCHEMBL29418248 0.78 SRC (0.58) L3MBTL1ALDH1A1LMNAHTTCA12
Phenyl Dihydrogen Phosphate SCHEMBL127595 0.78 SRC (0.58) L3MBTL1ALDH1A1LMNAHTTCA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1041115-B1 Curable resin composition KANSAI PAINT CO LTD (JP) 2003-07-09 EP disclosed
US-6346329-B1 CURABLE RESIN WITH EPOXIDE GROUPS AND CURING AGENT KANSAI PAINT CO., LTD. (JP) 2002-02-12 US disclosed
EP-1041115-A2 Curable resin composition KANSAI PAINT CO., LTD. (JP) 2000-10-04 EP disclosed
US-4968788-A DRUG DELIVERY, ANTITUMOR AGENTS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1990-11-06 US disclosed
WO-1990008155-A1 BIOLOGICALLY REVERSIBLE PHOSPHATE AND PHOSPHONATE PROTECTIVE GROUPS BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1990-07-26 WO disclosed
US-4816570-A Biologically reversible phosphate and phosphonate protective groups THE BOARD OF REGENTS OF THE UNIVERSITY OF TEXAS SYSTEM (US) 1989-03-28 US disclosed