Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL8767262

CCOC(=O)CC(=O)O.N

nearest known ligand 0.70

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.70
MGAM O43451 1/20 0.70
SI P14410 1/20 0.70
MGAM2 Q2M2H8 1/20 0.70
ALDH1A1 P00352 6/20 0.50
TRPA1 O75762 1/20 0.50
EGLN1 Q9GZT9 1/20 0.45
LMNA P02545 1/20 0.43
HSD17B10 Q99714 1/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 2/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALOX15 P16050 2/20 0.42
SOAT1 P35610 1/20 0.42
LDHA P00338 1/20 0.40
SRR Q9GZT4 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL30741390 0.97 GAA (0.74) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL15376 0.97
SCHEMBL11097044 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
Water SCHEMBL2811574 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL83057 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
Hydrochloric Acid SCHEMBL356491 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL3201235 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL13278763 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL3196229 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1
SCHEMBL1068040 0.95 GAA (0.70) GAAMGAMSIMGAM2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1997620-A Ionic liquids comprising nitrogen-containing cations UNIV YORK (GB) 2007-07-11 CN claimed
CN-1997620-B Ionic liquids comprising nitrogen-containing cations UNIV YORK 2012-10-03 CN disclosed
CN-102344379-A Ionic liquid containing nitrogen-containing cation UNIV YORK 2012-02-08 CN disclosed
CN-101316810-A Ionic liquids BIONIQS LTD (GB) 2008-12-03 CN disclosed
CN-100366231-C Terpenoid fragrance components stabilized with malonates UNILEVER NV (NL) 2008-02-06 CN disclosed
CN-1997620-A Ionic liquids comprising nitrogen-containing cations UNIV YORK (GB) 2007-07-11 CN disclosed
CN-1787800-A Terpenoid fragrance components stabilized with malonic acid salts UNILEVER NV (NL) 2006-06-14 CN disclosed
EP-0652213-B1 Method for producing alkyl 3-phthalidylideneacetate SUMIKA FINE CHEMICALS CO LTD (JP) 1997-08-27 EP disclosed
US-5508446-A Method for producing alkyl 3-phthalidylideneacetate SUMIKA FINE CHEMICALS CO., LTD. (JP) 1996-04-16 US disclosed
EP-0652213-A1 Method for producing alkyl 3-phthalidylideneacetate SUMIKA FINE CHEMICALS Co., Ltd. (JP) 1995-05-10 EP disclosed