Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL3640318

C(/C=C/c1ccccc1)=C\c1ccccc1.N.O=S(=O)(O)Oc1ccccc1

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 11/20 0.56
NFE2L2 Q16236 2/20 0.56
LMNA P02545 2/20 0.56
MAOB P27338 1/20 0.50
CISD1 Q9NZ45 1/20 0.46
STS P08842 1/20 0.44
TRPA1 O75762 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ALOX5 P09917 1/20 0.44
MAPK1 P28482 1/20 0.44
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC8 Q9BY41 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43

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
Ether SCHEMBL14777220 0.89 PPARG (0.46) PPARGNFE2L2LMNAMAOBCISD1
Ether SCHEMBL9339254 0.88 PPARG (0.47) PPARGNFE2L2LMNAMAOBCISD1
SCHEMBL28520144 0.85 CISD1 (0.57) PPARGNFE2L2LMNACISD1STS
Ammonia Solution, Strong SCHEMBL1115426 0.84 CA1 (0.56) PPARGNFE2L2LMNACISD1STS
SCHEMBL28760627 0.84 CA1 (0.56) PPARGNFE2L2LMNACISD1STS
SCHEMBL138895 0.82 CA2 (0.58) PPARGNFE2L2LMNACISD1STS
Diphenylether SCHEMBL15412522 0.81 MAOB (0.54) PPARGNFE2L2LMNAMAOBTRPA1
SCHEMBL17456405 0.80 CA1 (0.56) PPARGNFE2L2LMNACISD1STS
Water SCHEMBL2134977 0.80 CA1 (0.56) PPARGNFE2L2LMNACISD1STS
SCHEMBL8058040 0.80 CA1 (0.56) PPARGNFE2L2LMNACISD1STS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2184993-A2 AQUEOUS MICROEMULSIONS CONTAINING ORGANIC INSECTICIDE COMPOUNDS BASF SE (DE) 2010-05-19 EP disclosed
WO-2009019299-A2 AQUEOUS MICROEMULSIONS CONTAINING ORGANIC INSECTICIDE COMPOUNDS BASF SE (DE) 2009-02-12 WO disclosed