Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL8329475

CCCCC(CC)C(N)c1ccccc1.N

nearest known ligand 0.45

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.45
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
POLB P06746 1/20 0.40
LMNA P02545 1/20 0.38
HTR2A P28223 2/20 0.38
AOC3 Q16853 2/20 0.38
CSNK1E P49674 1/20 0.37
HRH1 P35367 1/20 0.37
SIGMAR1 Q99720 1/20 0.36
F2 P00734 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRD1 P41143 1/20 0.35
OPRK1 P41145 1/20 0.35
OPRL1 P41146 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
SCHEMBL1090571 0.84 CSNK1E (0.49) DPP4HTR2ACSNK1ESIGMAR1OPRM1
SCHEMBL28709961 0.84 CSNK1E (0.49) DPP4HTR2ACSNK1ESIGMAR1OPRM1
SCHEMBL1091524 0.84 CSNK1E (0.49) DPP4HTR2ACSNK1ESIGMAR1OPRM1
SCHEMBL13822592 0.82 DPP4 (0.59) DPP4KDM4ELMNAHTR2AF2
Hydrochloric Acid SCHEMBL4664397 0.82 CSNK1E (0.47) DPP4HTR2ACSNK1ESIGMAR1OPRM1
Hydrochloric Acid SCHEMBL11264234 0.82 CSNK1E (0.47) DPP4HTR2ACSNK1ESIGMAR1OPRM1
Hydrochloric Acid SCHEMBL4665738 0.82 CSNK1E (0.47) DPP4HTR2ACSNK1ESIGMAR1OPRM1
Hydrochloric Acid SCHEMBL1485805 0.82 CSNK1E (0.47) DPP4HTR2ACSNK1ESIGMAR1OPRM1
SCHEMBL27692950 0.82 DPP4 (0.45) DPP4HTR2AAOC3CSNK1EHRH1
SCHEMBL27692856 0.81 CSNK1E (0.46) DPP4HTR2AAOC3CSNK1ESIGMAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1998038182-A9 HYPOLIPIDEMIC BICYCLIC DERIVATIVES GLAXO GROUP LTD (GB) 1999-04-15 WO disclosed
WO-1998038182-A1 HYPOLIPIDEMIC BICYCLIC DERIVATIVES GLAXO GROUP LIMITED (GB) 1998-09-03 WO disclosed