Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL2911692

N.Nc1nc(CCCn2cc(-c3ccc(Cl)cc3Cl)cc2C(=O)N2CCC[C@H]2CN2CCCC2)ccc1[N+](=O)[O-]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MET P08581 9/20 0.41
HRH3 Q9Y5N1 5/20 0.41
CSF1R P07333 2/20 0.36
GSK3B P49841 2/20 0.36
GSK3A P49840 1/20 0.36
DPP4 P27487 1/20 0.34
DPP8 Q6V1X1 1/20 0.34
DPP9 Q86TI2 1/20 0.34

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 SCHEMBL2911455 0.87 HRH3 (0.41) METHRH3CSF1RGSK3BGSK3A
Ammonia Solution, Strong SCHEMBL2912310 0.86 HRH3 (0.41) METHRH3CSF1RGSK3BGSK3A
Ammonia Solution, Strong SCHEMBL2908714 0.82 SMN1; SMN2 (0.42) GSK3BGSK3ADPP4DPP8DPP9
SCHEMBL2912205 0.72 GSK3B (0.49) GSK3BGSK3ADPP4DPP8
SCHEMBL2907104 0.72 GSK3B (0.49) GSK3BGSK3ADPP4DPP8
SCHEMBL2914191 0.72 GSK3B (0.47) GSK3BGSK3A
Ammonia Solution, Strong SCHEMBL2909794 0.69 GSK3B (0.41) GSK3BGSK3ADPP4
Ammonia Solution, Strong SCHEMBL2906802 0.69 GSK3B (0.41) GSK3BGSK3ADPP4
SCHEMBL2903944 0.69 GSK3B (0.51) GSK3BGSK3A
Ammonia Solution, Strong SCHEMBL2912932 0.68 SMN1; SMN2 (0.47) GSK3BGSK3ADPP4DPP8DPP9

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-1537099-B1 PYRROLE BASED INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 NOVARTIS VACCINES & DIAGNOSTIC (US) 2010-08-11 EP disclosed