Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL11113923

CCCCCCOC(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.N

nearest known ligand 0.44

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Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.44
CES2 O00748 1/20 0.44
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
EPHX1 P07099 1/20 0.42
TSHR P16473 3/20 0.41
CES1 P23141 1/20 0.40
HCAR2 Q8TDS4 1/20 0.39
RAD52 P43351 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
FAAH O00519 1/20 0.38
ALDH1A1 P00352 1/20 0.38
LMNA P02545 1/20 0.38
ACHE P22303 5/20 0.38

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 SCHEMBL19461493 1.00 NAAA (0.44) NAAACES2CA1CA2EPHX1
SCHEMBL5163852 0.98 NAAA (0.46) NAAACES2CA1CA2EPHX1
SCHEMBL28898500 0.98 NAAA (0.46) NAAACES2CA1CA2EPHX1
SCHEMBL31272734 0.98 NAAA (0.46) NAAACES2CA1CA2EPHX1
SCHEMBL30655849 0.97 NAAA (0.47) NAAACES2CA1CA2EPHX1
SCHEMBL30655745 0.97 NAAA (0.47) NAAACES2CA1CA2EPHX1
SCHEMBL2691961 0.95 NAAA (0.44) NAAACES2CA1CA2EPHX1
Ammonia Solution, Strong SCHEMBL26977349 0.93 CA1 (0.45) NAAACES2CA1CA2EPHX1
SCHEMBL2690623 0.92 NAAA (0.48) NAAACES2EPHX1TSHRCES1
SCHEMBL30475147 0.92 NAAA (0.48) NAAACES2EPHX1TSHRCES1

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-0115446-A2 Metal film imaging structure MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1984-08-08 EP disclosed