Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL8865735

CC(Cc1ccc(OCc2ccccc2)cc1)c1ccccc1.N

nearest known ligand 0.67

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BCHE P06276 4/20 0.65
LTA4H P09960 1/20 0.55
SIGMAR1 Q99720 1/20 0.55
MAOB P27338 3/20 0.53
MAOA P21397 1/20 0.53
ALOX5 P09917 1/20 0.52
LMNA P02545 1/20 0.51
CYP1A2 P05177 1/20 0.51
PTGS1 P23219 1/20 0.51
SLC6A2 P23975 1/20 0.51
CYP2C19 P33261 1/20 0.51
PTGS2 P35354 1/20 0.51
SLC6A3 Q01959 1/20 0.51
HIF1A Q16665 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
PPARG P37231 2/20 0.51
PPARA Q07869 2/20 0.51
FFAR1 O14842 1/20 0.50
FFAR4 Q5NUL3 1/20 0.50

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
Ammonia Solution, Strong SCHEMBL8865799 0.97 BCHE (0.61) BCHELTA4HSIGMAR1MAOBMAOA
Ammonia Solution, Strong SCHEMBL8866041 0.95 BCHE (0.58) BCHELTA4HSIGMAR1MAOBMAOA
Fumaric Acid SCHEMBL8866259 0.89 ALDH1A1 (0.54) BCHELTA4HMAOBALOX5PPARG
Fumaric Acid SCHEMBL8976478 0.86 ALDH1A1 (0.54) BCHELTA4HMAOBALOX5PPARG
Fumaric Acid SCHEMBL9053859 0.84 ALDH1A1 (0.55) BCHEMAOBALOX5LMNAPPARG
SCHEMBL6552065 0.84 BCHE (0.52) BCHELTA4HSIGMAR1MAOBMAOA
SCHEMBL2736160 0.83 LTA4H (0.61) BCHELTA4HSIGMAR1MAOBMAOA
Ammonia Solution, Strong SCHEMBL5082413 0.82 TAAR1 (0.54) SIGMAR1MAOASLC6A2SLC6A3
SCHEMBL1042574 0.82 BCHE (0.48) BCHESIGMAR1MAOBFFAR1
Ammonia Solution, Strong SCHEMBL8976504 0.81 MEN1 (0.57) LTA4HSIGMAR1CYP1A2CYP2C19PPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5605916-A Arylalkyl-amines having anticonvulsant and neuroprotective properties ASTRA AB (SE) 1997-02-25 US disclosed
US-5539120-A Arylalkyl-amines having anticonvulsant and neuroprotective properties AGENCE SPATIALE EUROPEENNE (FR) 1996-07-23 US disclosed
EP-0356035-B1 Arylkalkyl-amines and -amides having anticonvulsant and neuroprotective properties ASTRA AB (SE) 1996-03-13 EP disclosed
US-5430044-A Arylalkyl-amines and -amides having anticonvulsant and neuroprotective properties FISONS CORPORATION (GB) 1995-07-04 US disclosed
EP-0648745-A1 Arylalkylamine having anticonvulsant and neuroprotective properties Astra Aktiebolag (SE) 1995-04-19 EP disclosed
EP-0648489-A1 Arylalkylamides having neuroprotective properties FISONS CORPORATION (US) 1995-04-19 EP disclosed
US-5331007-A Arylalkyl-amines and -amides having anticonvulsant and neuroprotective properties FISONS CORPORATION (US) 1994-07-19 US disclosed
WO-1991011995-A1 ARYLALKYL-AMINES AND -AMIDES HAVING ANTICONVULSANT AND NEUROPROTECTIVE PROPERTIES FISONS CORPORATION (US) 1991-08-22 WO disclosed
EP-0356035-A2 Arylkalkyl-amines and -amides having anticonvulsant and neuroprotective properties Astra Aktiebolag (SE) 1990-02-28 EP disclosed