Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL6964589

CC12CC3CC(CC(C3)C1)C2.N

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 6/20 0.43
GRIN2A Q12879 6/20 0.43
GRIN2D O15399 5/20 0.43
GRIN3B O60391 5/20 0.43
GRIN2B Q13224 5/20 0.43
GRIN2C Q14957 5/20 0.43
GRIN3A Q8TCU5 5/20 0.43
LMNA P02545 4/20 0.42
SLC22A2 O15244 2/20 0.42
SLC47A1 Q96FL8 2/20 0.42
SLC22A1 O15245 2/20 0.42
NFKB1 P19838 2/20 0.42
TSHR P16473 1/20 0.42
STAT6 P42226 1/20 0.42
SIGMAR1 Q99720 1/20 0.42
PMP22 Q01453 2/20 0.40
POLB P06746 1/20 0.40
THRB P10828 1/20 0.40
BLM P54132 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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 SCHEMBL28253098 0.97 GRIN1 (0.41) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL453075 0.96 GRIN1 (0.45) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL3361 0.96 GRIN1 (0.45) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
SCHEMBL28327525 0.96 GRIN1 (0.45) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Methane SCHEMBL7511046 0.94 LMNA (0.43) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Phosphine SCHEMBL25178082 0.93 GRIN1 (0.43) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Water SCHEMBL27642476 0.93 GRIN1 (0.43) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Hydrochloric Acid SCHEMBL11259068 0.93 LMNA (0.47) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B
Acetic Acid SCHEMBL9168733 0.80 THRB (0.41) TSHRTHRBEPHX2CYP2C9
Formic Acid SCHEMBL29158120 0.80 EPHX2 (0.41) GRIN1GRIN2AGRIN2DGRIN3BGRIN2B

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
CN-106745034-A A kind of method of molecular sieves of double template one-step synthesis SSZ 13 and its application 华中科技大学 2017-05-31 CN disclosed
EP-0882023-B1 HISTAMINE H 3 RECEPTOR LIGANDS BLACK JAMES FOUNDATION (GB) 2003-06-04 EP disclosed
US-6080871-A ANTIHISTAMINES JAMES BLACK FOUNDATION LIMITED (GB) 2000-06-27 US disclosed
EP-0882023-A1 HISTAMINE H 3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1998-12-09 EP disclosed
WO-1997029092-A1 HISTAMINE H3 RECEPTOR LIGANDS JAMES BLACK FOUNDATION LIMITED (GB) 1997-08-14 WO disclosed