Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL4399088

Cc1cc(C)c(-c2nc(N)ncc2-c2ccc3ncccc3c2)c(C)c1.N

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 8/20 0.48
ADORA2A P29274 6/20 0.48
KDR P35968 2/20 0.47
LCK P06239 1/20 0.47
JAK3 P52333 1/20 0.47
MAPK14 Q16539 1/20 0.47
NPC1 O15118 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
DYRK1A Q13627 1/20 0.46
ALDH1A1 P00352 2/20 0.44
DHFR P00374 1/20 0.42
KDM4E B2RXH2 1/20 0.41
TP53 P04637 1/20 0.41
HSP90AA1 P07900 1/20 0.41
HSP90AB1 P08238 1/20 0.41
MAPT P10636 1/20 0.41
TSHR P16473 1/20 0.41
CASP1 P29466 1/20 0.41
HTT P42858 1/20 0.41

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 SCHEMBL4401603 0.80 DYRK1A (0.47) ADORA1ADORA2AKDRLCKJAK3
Ammonia Solution, Strong SCHEMBL6500596 0.79 QPCT (0.46) ADORA1ADORA2AKDRLCKJAK3
SCHEMBL4399087 0.79 LCK (0.45) ADORA1ADORA2AKDRLCKJAK3
SCHEMBL3721487 0.78 DHFR (0.68) ADORA1ADORA2AKDRLCKJAK3
Ammonia Solution, Strong SCHEMBL6496905 0.77 RPS6KA3 (0.46) ADORA1ADORA2AKDRLCKJAK3
Ammonia Solution, Strong SCHEMBL6529235 0.76 MAPKAPK2 (0.54) ADORA1ADORA2ARAB9ADYRK1AALDH1A1
Ammonia Solution, Strong SCHEMBL4396798 0.76 ADORA1 (0.42) ADORA1ADORA2AKDRLCKJAK3
Ammonia Solution, Strong SCHEMBL6527759 0.75 MAPT (0.46) ADORA1ADORA2ANPC1POLBRAB9A
Ammonia Solution, Strong SCHEMBL6500606 0.75 KMT2A (0.48) ADORA1ADORA2AALDH1A1DHFRKDM4E
SCHEMBL28019339 0.69 LCK (0.64) ADORA1ADORA2AKDRLCKJAK3

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-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
WO-2007075911-A2 INHIBITION OF GLYCOGEN SYNTHASE KINASE AND METHODS OF TREATING AUTOIMMUNE OR IMMUNE INFLAMMATORY DISEASE YALE UNIVERSITY (US) 2007-07-05 WO 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 2203/4885KDR 2342/4885
US-20050004125-A1 Heteroaryl amines as glycogen synthase kinase 3beta inhibitors (gsk3 inhibitors) GSK3B, GSK3A, GSKIP ADORA1 1486/4885ADORA2A 2407/4885KDR 2089/4885

“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.