Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL18106936

CC(C)CN1CCCC1.N

nearest known ligand 0.48

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Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 5/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
MAPT P10636 2/20 0.44
ATM Q13315 1/20 0.44
CYP2D6 P10635 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ANPEP P15144 1/20 0.37
ERAP2 Q6P179 1/20 0.37
ALDH1A1 P00352 2/20 0.36
HPGD P15428 1/20 0.36
CHRM2 P08172 1/20 0.36
ADRA2B P18089 1/20 0.36
DRD3 P35462 1/20 0.36
SIGMAR1 Q99720 1/20 0.36
HRH3 Q9Y5N1 1/20 0.36
HSD17B10 Q99714 1/20 0.35
LMNA P02545 1/20 0.35
HTR7 P34969 1/20 0.35

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 SCHEMBL27995853 0.97 PIK3CD (0.46) PIK3CDMEN1KMT2AMAPTATM
SCHEMBL101925 0.97
SCHEMBL4924066 0.97
Ammonia Solution, Strong SCHEMBL28006932 0.95 MEN1 (0.50) PIK3CDMEN1KMT2AMAPTATM
SCHEMBL426509 0.94 MEN1 (0.55) PIK3CDMEN1KMT2AMAPTATM
Iodide SCHEMBL31035714 0.94 PIK3CD (0.48) PIK3CDMEN1KMT2AMAPTATM
SCHEMBL425336 0.94 MEN1 (0.55) PIK3CDMEN1KMT2AMAPTATM
SCHEMBL19969742 0.94 MEN1 (0.55) PIK3CDMEN1KMT2AMAPTATM
Hydrochloric Acid SCHEMBL28126144 0.94 PIK3CD (0.48) PIK3CDMEN1KMT2AMAPTATM
SCHEMBL13635633 0.94 MEN1 (0.55) PIK3CDMEN1KMT2AMAPTATM

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-2275107-B1 Combinations for the treatment of diseases involving cell proliferation BOEHRINGER INGELHEIM INT (DE) 2016-10-05 EP disclosed