Methylglyoxal

Methylglyoxal

SCHEMBL9771966

CC(=O)C=O.CC(=O)CC(C)=O

nearest known ligand 0.43

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.43
GAA P10253 1/20 0.43
SI P14410 1/20 0.43
MGAM2 Q2M2H8 1/20 0.43
HTT P42858 2/20 0.39
ALDH1A1 P00352 5/20 0.39
TDP1 Q9NUW8 2/20 0.39
KDM4E B2RXH2 2/20 0.38
KDM6B O15054 1/20 0.38
KDM5C P41229 1/20 0.38
EGLN1 Q9GZT9 1/20 0.38
PHF8 Q9UPP1 1/20 0.38
KDM2A Q9Y2K7 1/20 0.38
TRPA1 O75762 1/20 0.37
LMNA P02545 3/20 0.32
SLC15A2 Q16348 1/20 0.32
CA2 P00918 1/20 0.32
PTGS1 P23219 1/20 0.32
MMP12 P39900 1/20 0.32
NFKB1 P19838 1/20 0.30

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
SCHEMBL2128645 0.82 MGAM (0.56) MGAMGAASIMGAM2HTT
SCHEMBL10389469 0.82 MGAM (0.56) MGAMGAASIMGAM2HTT
Methylglyoxal SCHEMBL1144855 0.82 ALDH1A1 (0.50) ALDH1A1TDP1KDM4ETRPA1LMNA
SCHEMBL1608 0.82
Methylglyoxal SCHEMBL47032 0.82
Formamide SCHEMBL11769330 0.80 MGAM (0.43) MGAMGAASIMGAM2HTT
Water SCHEMBL23151837 0.78 MGAM (0.53) MGAMGAASIMGAM2HTT
SCHEMBL21404935 0.78
Methyl Alcohol SCHEMBL9405810 0.78
SCHEMBL21404928 0.78

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-5055442-A CARRIER FOR CATALYST AND METHOD FOR PRODUCTION THEREOF NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1991-10-08 US disclosed
EP-0383636-A1 Carrier for catalyst and method for production thereof NIPPON SHOKUBAI CO., LTD. (JP) 1990-08-22 EP disclosed