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Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6522827

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

nearest known ligand 0.36

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Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ CPT2 P23786 1/20 0.36
▸ ACLY P53396 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.34
▸ HTT P42858 1/20 0.34
▸ CYP2D6 P10635 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HIF1A Q16665 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.31
▸ HMGCR P04035 1/20 0.30
▸ CHRM1 P11229 1/20 0.30
▸ TBXA2R P21731 1/20 0.30
▸ ADRA1A P35348 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 SCHEMBL10939985 1.00 CPT2 (0.36) CPT2ACLYALDH1A1HTTCYP2D6
Ammonia Solution, Strong SCHEMBL9273494 1.00 CPT2 (0.36) CPT2ACLYALDH1A1HTTCYP2D6
SCHEMBL5862554 0.98 ACLY (0.38) CPT2ACLYALDH1A1HTTCYP2D6
SCHEMBL9236937 0.96 CPT2 (0.36) CPT2ACLYALDH1A1HTTCYP2D6
SCHEMBL27534725 0.94 CPT2 (0.35) CPT2ACLYALDH1A1HTTCYP2D6
SCHEMBL1553184 0.92 TSHR (0.39) CPT2ACLYALDH1A1HTTCYP2D6
Potassium Ion SCHEMBL11228794 0.89 CPT2 (0.32) CPT2ACLYALDH1A1HTT
Ammonia Solution, Strong SCHEMBL5048410 0.84 CYP2D6 (0.35) CPT2ACLYALDH1A1CYP2D6TSHR
SCHEMBL3071716 0.83 TDP1 (0.43) CPT2ACLYTDP1
SCHEMBL653302 0.82 CYP2C19 (0.37) CPT2ACLYALDH1A1CYP2D6TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6946653-B2 Methods and apparatus for improved laser desorption ionization tandem mass spectrometry CIPHERGEN BIOSYSTEMS, INC. (US) 2005-09-20 — — US disclosed
EP-1451851-A1 METHODS AND APPARATUS FOR IMPROVED LASER DESORPTION IONIZATION TANDEM MASS SPECTROMETRY Ciphergen Biosystems, Inc. (US) 2004-09-01 — — EP disclosed
WO-2003046944-A1 METHODS AND APPARATUS FOR IMPROVED LASER DESORPTION IONIZATION TANDEM MASS SPECTROMETRY CIPHERGEN BIOSYSTEMS, INC. (US) 2003-06-05 — — WO disclosed
US-20030098413-A1 Methods and apparatus for improved laser desorption ionization tandem mass spectrometry CIPHERGEN BIOSYSTEMS, INC. 2003-05-29 — — US disclosed