Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4396798

Cc1cc(C)c(-c2nc(N)ncc2-c2ccc3[nH]nnc3c2)c(C)c1.N

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 9/20 0.42
ADORA2A P29274 5/20 0.40
LCK P06239 1/20 0.39
KDR P35968 1/20 0.39
JAK3 P52333 1/20 0.39
MAPK14 Q16539 1/20 0.39
RPS6KA3 P51812 1/20 0.39
KMT2A Q03164 1/20 0.36
DHFR P00374 2/20 0.36
MAPKAPK2 P49137 2/20 0.36
MAP3K14 Q99558 2/20 0.35
FGFR1 P11362 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 SCHEMBL6529235 0.83 MAPKAPK2 (0.54) ADORA1ADORA2ARPS6KA3KMT2AMAPKAPK2
SCHEMBL4396796 0.81 LCK (0.38) ADORA1ADORA2ALCKKDRJAK3
Ammonia Solution, Strong SCHEMBL6500596 0.79 QPCT (0.46) ADORA1ADORA2ALCKKDRJAK3
Ammonia Solution, Strong SCHEMBL4399088 0.76 ADORA1 (0.48) ADORA1ADORA2ALCKKDRJAK3
Ammonia Solution, Strong SCHEMBL4401603 0.75 DYRK1A (0.47) ADORA1ADORA2ALCKKDRJAK3
Ammonia Solution, Strong SCHEMBL6496905 0.74 RPS6KA3 (0.46) ADORA1ADORA2ALCKKDRJAK3
Ammonia Solution, Strong SCHEMBL6527759 0.73 MAPT (0.46) ADORA1ADORA2ARPS6KA3KMT2A
Ammonia Solution, Strong SCHEMBL6500606 0.72 KMT2A (0.48) ADORA1ADORA2ARPS6KA3KMT2ADHFR
SCHEMBL27462618 0.68 POLB (0.35) MAPKAPK2
SCHEMBL30494163 0.67 CLK2 (0.48)

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-20050004125-A1 Heteroaryl amines as glycogen synthase kinase 3beta inhibitors (gsk3 inhibitors) JANSSEN PHARMACEUTICA N.V. (BE) 2005-01-06 US claimed
US-20090306045-A1 Inhibition of Glycogen Synthase Kinase and Methods of Treating Autoimmune or Immune Inflammatory Disease NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2009-12-10 US disclosed
US-7514445-B2 Heteroaryl amines as glycogen synthase kinase 3β inhibitors (GSK3 inhibitors) JANSSEN PHARMACEUTICA N.V. (BE) 2009-04-07 US disclosed
US-20050004125-A1 Heteroaryl amines as glycogen synthase kinase 3beta inhibitors (gsk3 inhibitors) JANSSEN PHARMACEUTICA N.V. (BE) 2005-01-06 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 (2 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-20090306045-A1 Inhibition of Glycogen Synthase Kinase and Methods of Treating Autoimmune or Immune Inflammatory Disease GSK3B, GSK3A, GSKIP ADORA1 2287/4885ADORA2A 2203/4885LCK 146/4885
US-20050004125-A1 Heteroaryl amines as glycogen synthase kinase 3beta inhibitors (gsk3 inhibitors) GSK3B, GSK3A, GSKIP ADORA1 1486/4885ADORA2A 2407/4885LCK 1894/4885

“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.