Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL3708348

COc1cc(Br)ccc1Nc1nc(C2CCCCC2)c2nc[nH]c2n1.N

nearest known ligand 0.40

Full drug profile on Sugi Atlas →

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TTK P33981 16/20 0.40
CLK1 P49759 3/20 0.38
CLK2 P49760 3/20 0.38
CAMKK2 Q96RR4 1/20 0.38
PIK3CB P42338 1/20 0.37
MAPK8 P45983 1/20 0.37
PTK2 Q05397 1/20 0.37
GAA P10253 1/20 0.37
IGF1R P08069 1/20 0.36
CCNA2 P20248 1/20 0.35
CDK2 P24941 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
SCHEMBL3040661 0.83 TTK (0.53) TTKCLK1CLK2PIK3CBMAPK8
Ammonia Solution, Strong SCHEMBL3707460 0.74 TTK (0.42) TTKPIK3CBMAPK8PTK2
SCHEMBL4766150 0.72 TTK (0.54) TTKPIK3CBMAPK8PTK2GAA
Ammonia Solution, Strong SCHEMBL3695338 0.71 LRRK2 (0.41) TTK
SCHEMBL4766022 0.71 TTK (0.52) TTKCLK1CLK2PIK3CBMAPK8
SCHEMBL4766587 0.71 MAPT (0.45) TTKGAA
Ammonia Solution, Strong SCHEMBL3704523 0.70 TTK (0.51) TTKCAMKK2PIK3CBMAPK8PTK2
SCHEMBL3703793 0.70 TTK (0.49) TTKPIK3CBMAPK8PTK2
SCHEMBL2948829 0.70 TTK (0.55) TTKPIK3CBMAPK8PTK2
SCHEMBL3711102 0.69 TTK (0.51) TTKCLK1CLK2PIK3CBMAPK8

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
US-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF MYREXIS, INC. (US) 2012-05-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120122840-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF VHL, TP53, ASAH2 TTK 4589/4885CLK1 3989/4885CLK2 2733/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.