Quinoline

Quinoline

SCHEMBL28828322

c1cc[nH]c1.c1ccc2ncccc2c1.c1cocn1

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
NR4A2 P43354 1/20 0.37
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
POLB P06746 2/20 0.35
PDE10A Q9Y233 1/20 0.35
CYP3A4 P08684 2/20 0.34
HTT P42858 3/20 0.33
CASP1 P29466 2/20 0.33
KDM4E B2RXH2 2/20 0.33
TP53 P04637 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.33
HSD17B10 Q99714 2/20 0.33
MAPT P10636 2/20 0.33
MEN1 O00255 1/20 0.33
CASP7 P55210 1/20 0.33
KMT2A Q03164 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSP90AA1 P07900 1/20 0.33

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
Quinoline SCHEMBL27296262 0.91 ALDH1A1 (0.63) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL27697682 0.89 ALDH1A1 (0.61) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL27761359 0.89 ALDH1A1 (0.61) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL28231339 0.89 ALDH1A1 (0.61) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL28850195 0.84 ALDH1A1 (0.55) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL28183388 0.84 ALDH1A1 (0.59) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL27319315 0.83 ALDH1A1 (0.74) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL5567268 0.83 ALDH1A1 (0.74) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL28798085 0.83 ALDH1A1 (0.46) ALDH1A1NR4A2NPC1RAB9APOLB
Quinoline SCHEMBL28800269 0.82 ALDH1A1 (0.71) ALDH1A1NR4A2NPC1RAB9APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105492594-A Bacterial fermentation process and composition NEWLEAF SYMBIOTICS INC 2016-04-13 CN disclosed