SCHEMBL7159155

SCHEMBL7159155

OBO.c1ccc(N=Nc2ccccn2)nc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.65
MAOB P27338 2/20 0.65
ADRA2A P08913 3/20 0.54
ADRA2B P18089 3/20 0.54
ADRA2C P18825 3/20 0.54
PLAU P00749 1/20 0.54
LMNA P02545 3/20 0.53
KDM4E B2RXH2 2/20 0.53
MAPT P10636 2/20 0.53
OPRK1 P41145 2/20 0.53
HTT P42858 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
TDP1 Q9NUW8 2/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
HPGD P15428 2/20 0.53
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
POLB P06746 1/20 0.53
HSP90AA1 P07900 1/20 0.53

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
SCHEMBL275526 0.90 MAOA (0.77) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL2470956 0.90 MAOA (0.77) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL29785641 0.90 MAOA (0.77) MAOAMAOBADRA2AADRA2BADRA2C
Benzene SCHEMBL10803509 0.87 MAOA (0.82) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL2557888 0.87 MAOA (0.74) MAOAMAOBADRA2AADRA2BADRA2C
Phenol SCHEMBL28552055 0.82 MAOA (0.67) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL10340480 0.81
SCHEMBL670019 0.79 MAOA (1.00) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL670018 0.79 MAOA (1.00) MAOAMAOBADRA2AADRA2BADRA2C
SCHEMBL1128642 0.79 LMNA (0.65) MAOAMAOBADRA2AADRA2BADRA2C

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
US-6534316-B2 Detecting fructose in sample; prepare solution in mixed water/aprotic polar solvent, measure absorbance or fluorescence of the solution, evaluate for frutose BOARD OF SUPERVISORS OF LOUISIANA STATE UNIVERSITY AND AGRICULTURAL AND MECHANICAL COLLEGE 2003-03-18 US disclosed
US-20020142475-A1 Colorimetric and Fluorimetric analysis of carbohydrates BOARD OF SUPERVISORS OF LA. STATE UN. & AGRICULTURAL AND MECHANICAL COLLEGE 2002-10-03 US disclosed