Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6324726

Cc1ccccc1C=CC(=O)O.N

nearest known ligand 0.60

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
NFKB1 P19838 1/20 0.60
CA4 P22748 1/20 0.60
PTGER3 P43115 7/20 0.54
PTGER2 P43116 7/20 0.54
PTGER4 P35408 6/20 0.54
PTGER1 P34995 3/20 0.54
HDAC3 O15379 1/20 0.52
TNKS O95271 1/20 0.52
HDAC4 P56524 1/20 0.52
HDAC1 Q13547 1/20 0.52
HCAR2 Q8TDS4 1/20 0.52
HDAC7 Q8WUI4 1/20 0.52
HDAC2 Q92769 1/20 0.52
HDAC10 Q969S8 1/20 0.52
HDAC11 Q96DB2 1/20 0.52
HDAC8 Q9BY41 1/20 0.52
TNKS2 Q9H2K2 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52

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 SCHEMBL6324720 1.00 CA1 (0.60) CA1CA2NFKB1CA4PTGER3
SCHEMBL29386378 0.98 CA1 (0.62) CA1CA2NFKB1CA4PTGER3
SCHEMBL2425317 0.98 CA1 (0.62) CA1CA2NFKB1CA4PTGER3
SCHEMBL78556 0.98 CA1 (0.62) CA1CA2NFKB1CA4PTGER3
SCHEMBL78555 0.98 CA1 (0.62) CA1CA2NFKB1CA4PTGER3
Hydrochloric Acid SCHEMBL9445634 0.96 CA1 (0.60) CA1CA2NFKB1CA4PTGER3
SCHEMBL5666236 0.96 CA1 (0.60) CA1CA2NFKB1CA4PTGER3
SCHEMBL5666241 0.96 CA1 (0.60) CA1CA2NFKB1CA4PTGER3
Hydrochloric Acid SCHEMBL16239458 0.96 CA1 (0.60) CA1CA2NFKB1CA4PTGER3
Tert-Butylamine SCHEMBL1879651 0.89 CA1 (0.53) CA1CA2NFKB1CA4PTGER3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6876540-B2 Electrolyte for use in a capacitor EPCOS AG (DE) 2005-04-05 US claimed
US-20040114308-A1 Electrolyte for an aluminium-electrolyte capacitor, capacitor which uses the electrolyte and the use of said capacitor EPCOS AG (DE) 2004-06-17 US claimed
US-6876540-B2 Electrolyte for use in a capacitor EPCOS AG (DE) 2005-04-05 US disclosed
US-20050050587-A1 Inducers of plant disease resistance VALENT BIOSCIENCES CORPORATION 2005-03-03 US disclosed
US-20040114308-A1 Electrolyte for an aluminium-electrolyte capacitor, capacitor which uses the electrolyte and the use of said capacitor EPCOS AG (DE) 2004-06-17 US disclosed