Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL23749095

CCc1cccc(S(=O)(=O)O)c1CC.N

nearest known ligand 0.43

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 3/20 0.43
GABRB2 P47870 3/20 0.43
TTR P02766 1/20 0.39
CTSB P07858 1/20 0.39
MYC P01106 1/20 0.37
CYP1A2 P05177 1/20 0.36
HSD11B1 P28845 1/20 0.36
NR4A1 P22736 1/20 0.35
TAAR1 Q96RJ0 2/20 0.34
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
HIF1A Q16665 1/20 0.34
HSD17B10 Q99714 1/20 0.34
HTR1A P08908 1/20 0.34
HTT P42858 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33

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
SCHEMBL2052228 0.98 GABRA1 (0.45) GABRA1GABRB2TTRCTSBMYC
Hydrochloric Acid SCHEMBL28255119 0.96 GABRA1 (0.43) GABRA1GABRB2TTRCTSBMYC
SCHEMBL16742519 0.83 GABRA1 (0.41) GABRA1GABRB2TTRCTSBCYP1A2
SCHEMBL8764088 0.82 BID (0.46) HSD17B10
SCHEMBL11578050 0.82 BID (0.46) HSD17B10
Ammonia Solution, Strong SCHEMBL23749173 0.82 CTSB (0.50) GABRA1GABRB2TTRCTSBMYC
SCHEMBL10915427 0.82 GABRA1 (0.43) GABRA1GABRB2CTSBHSD11B1TAAR1
SCHEMBL1275170 0.81 RAPGEF4 (0.42) GABRA1GABRB2TTRMYCCYP1A2
SCHEMBL15208027 0.81 BID (0.44) HSD17B10
Ammonia Solution, Strong SCHEMBL23749073 0.80 TTR (0.36) GABRA1GABRB2TTRCTSBMYC

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-3864963-A1 OILY SUSPENSION AGROCHEMICAL COMPOSITION Kumiai Chemical Industry Co., Ltd. (JP) 2021-08-18 EP disclosed