Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL9153449

N.N.NCC(CC(=O)O)C(CC(=O)O)(CC(=O)O)NCC(=O)O

nearest known ligand 0.38

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABRR1 P24046 2/20 0.38
LMNA P02545 1/20 0.38
TDP1 Q9NUW8 1/20 0.37
CACNA2D1 P54289 2/20 0.32
CACNB3 P54284 1/20 0.32
CACNA1C Q13936 1/20 0.32
PGR P06401 1/20 0.32
ADRA1A P35348 1/20 0.32
HTR2B P41595 1/20 0.32
CACNA2D2 Q9NY47 1/20 0.32
KDM4E B2RXH2 1/20 0.31
GABBR2 O75899 1/20 0.31
GABBR1 Q9UBS5 1/20 0.31
ALDH1A1 P00352 1/20 0.30

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 SCHEMBL9133439 1.00 GABRR1 (0.38) GABRR1LMNATDP1CACNA2D1CACNB3
Ammonia Solution, Strong SCHEMBL8078632 0.98 GABRR1 (0.36) GABRR1LMNATDP1CACNA2D1CACNB3
SCHEMBL6639635 0.98 GABRR1 (0.39) GABRR1LMNATDP1CACNA2D1CACNB3
Water SCHEMBL8747201 0.96 GABRR1 (0.38) GABRR1LMNATDP1CACNA2D1CACNB3
SCHEMBL5690748 0.95 GABRR1 (0.36) GABRR1LMNATDP1CACNA2D1CACNB3
SCHEMBL8747255 0.86 GABRR1 (0.31) GABRR1LMNATDP1
SCHEMBL9810936 0.84 GABRR1 (0.32) GABRR1LMNA
SCHEMBL6551964 0.82 GABRR1 (0.35) GABRR1LMNATDP1CACNA2D1CACNB3
SCHEMBL4581476 0.82 GSR (0.37) GABRR1LMNAGABBR2GABBR1ALDH1A1
Ammonia Solution, Strong SCHEMBL3115882 0.79 TDP1 (0.38) GABRR1LMNATDP1

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
US-5441852-A Replaces formaldehyde with a meta substituted benzaldehyde KONICA CORPORATION (JP) 1995-08-15 US disclosed