Pyridine

Pyridine

SCHEMBL28100148

NC(CC(=O)O)C(=O)OCc1ccccc1.c1ccncc1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.48
TDP1 Q9NUW8 2/20 0.48
POLB P06746 1/20 0.48
LMNA P02545 1/20 0.48
LTA4H P09960 3/20 0.47
SLC15A1 P46059 2/20 0.45
IDO1 P14902 1/20 0.44
ALDH1A1 P00352 3/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MAPK1 P28482 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
SLC6A2 P23975 1/20 0.42
SLC6A3 Q01959 1/20 0.42
LAP3 P28838 1/20 0.42
ANPEP P15144 1/20 0.41
SLC1A3 P43003 2/20 0.41
SLC1A2 P43004 2/20 0.41
SLC1A1 P43005 2/20 0.41
MEN1 O00255 1/20 0.41
CYP1A2 P05177 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
SCHEMBL304415 0.91 LTA4H (0.54) KMT2ATDP1LTA4HSLC15A1IDO1
SCHEMBL27873595 0.91 LTA4H (0.54) KMT2ATDP1LTA4HSLC15A1IDO1
SCHEMBL169622 0.91 LTA4H (0.54) KMT2ATDP1LTA4HSLC15A1IDO1
Hydrochloric Acid SCHEMBL27032949 0.89 LTA4H (0.52) KMT2ATDP1LTA4HSLC15A1IDO1
Hydrochloric Acid SCHEMBL6506547 0.89 LTA4H (0.52) KMT2ATDP1LTA4HSLC15A1IDO1
Ethylene Glycol SCHEMBL27703651 0.86 LTA4H (0.50) KMT2ATDP1LTA4HSLC15A1IDO1
SCHEMBL30531163 0.84 LTA4H (0.48) KMT2ATDP1LTA4HSLC15A1IDO1
SCHEMBL5868369 0.82 LTA4H (0.50) KMT2ALTA4HSLC15A1IDO1ALDH1A1
Cysteamine SCHEMBL28350891 0.82 LTA4H (0.47) KMT2ATDP1LTA4HSLC15A1IDO1
Dl-Phenylalanine SCHEMBL28296822 0.82 SLC7A5 (0.65) LTA4HSLC15A1ALDH1A1LAP3SLC1A3

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-104258391-B A kind of multi-functional stimulation sensitive polymer-nanometer gold cage carrier and preparation method thereof 中山大学 2016-09-14 CN claimed