Ammonia Solution, Strong

Ammonia Solution, Strong

SCHEMBL747955

N.O=COc1ccc(C2CCN(c3ccc4nnc(C(F)(F)F)n4n3)CC2)cc1F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 7/20 0.51
KCNH2 Q12809 6/20 0.51
BRD4 O60885 5/20 0.51
HTT P42858 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
ALOX15 P16050 1/20 0.48
TP53 P04637 1/20 0.47
HSD17B10 Q99714 1/20 0.47
MAPT P10636 2/20 0.47
HPGD P15428 1/20 0.47
DPP4 P27487 3/20 0.46
DPP9 Q86TI2 1/20 0.46
DPP7 Q9UHL4 1/20 0.46
ALDH1A1 P00352 1/20 0.45
XBP1 P17861 1/20 0.45

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
Formic Acid SCHEMBL747953 0.85 AR (0.51) ARKCNH2BRD4HTTTDP1
SCHEMBL750560 0.82 HTT (0.56) ARKCNH2BRD4HTTTDP1
SCHEMBL749348 0.78 BRD4 (0.79) ARKCNH2BRD4DPP4DPP9
SCHEMBL2266350 0.77 HTT (0.62) ARKCNH2BRD4HTTTDP1
SCHEMBL748865 0.77 HTT (0.62) ARKCNH2BRD4HTTTDP1
SCHEMBL12368262 0.77 MAPT (0.70) ARKCNH2BRD4HTTTDP1
SCHEMBL2264757 0.75 HTT (0.57) ARKCNH2BRD4HTTTDP1
SCHEMBL2264697 0.75 HTT (0.57) ARKCNH2BRD4HTTTDP1
SCHEMBL2262571 0.75 AR (0.60) ARKCNH2BRD4HTTTDP1
SCHEMBL2265318 0.74 MAPT (0.54) ARKCNH2BRD4HTTTDP1

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
EP-2430024-A1 [1,2,4]TRIAZOLO [4,3-B]PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR AstraZeneca AB (SE) 2012-03-21 EP disclosed
WO-2010131022-A1 [1,2,4] TRIAZOLO [4,3-B] PYRIDAZINES AS LIGANDS OF THE ANDROGEN RECEPTOR ASTRAZENECA AB (SE) 2010-11-18 WO disclosed