Pyruvate

Pyruvate

SCHEMBL6571338

CC(=O)C(=O)O.CCOC(=O)[C@H](CS)NC(C)=O

nearest known ligand 0.56

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.56
KDM4E B2RXH2 1/20 0.56
THRB P10828 1/20 0.56
ALOX15 P16050 1/20 0.56
NFKB1 P19838 1/20 0.56
PTGS2 P35354 1/20 0.56
THPO P40225 1/20 0.56
RECQL P46063 1/20 0.56
BLM P54132 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
CAD P27708 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ALDH1A1 P00352 3/20 0.38
KMT2A Q03164 2/20 0.37
POLB P06746 1/20 0.37
TACR1 P25103 1/20 0.37
ACE P12821 1/20 0.36
CPB2 Q96IY4 1/20 0.35
LMNA P02545 2/20 0.35
HSD17B10 Q99714 1/20 0.34

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
Pyruvate SCHEMBL6573546 1.00 MAPT (0.56) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL4727586 0.93 MAPT (0.59) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL122644 0.93 MAPT (0.59) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL122645 0.93 MAPT (0.59) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL929076 0.86 KDM4E (0.52) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL930333 0.86 KDM4E (0.52) MAPTKDM4ETHRBALOX15NFKB1
Cysteamine SCHEMBL20768365 0.85 ALOX15 (0.50) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL9292612 0.80 KDM4E (0.44) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL9292614 0.80 KDM4E (0.44) MAPTKDM4ETHRBALOX15NFKB1
SCHEMBL4990411 0.80 CAD (0.44) MAPTKDM4ETHRBALOX15NFKB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1009377-A4 MEDICAL USES OF PYRUVATES UNIV CASE WESTERN RESERVE (US) 2004-01-21 EP disclosed
US-6086789-A SKIN INJURIES CASE WESTERN RESERVE UNIVERSITY (US) 2000-07-11 US disclosed
EP-1009377-A1 MEDICAL USES OF PYRUVATES Case Western Reserve University (US) 2000-06-21 EP disclosed
US-5968727-A SOLUTION FOR LONG TERM PRESERVATION OF TRANSPLANTABLE ORGANS DEPRIVED OF OXYGEN CASE WESTERN RESERVE UNIVERSITY (US) 1999-10-19 US disclosed
US-5876916-A ADMINISTRATION OF GLYCEROL-PYRUVATE OR HYDROXYACETONE PYRUVATE ESTER WITH BIOCOMPATIBLE CARRIER TO MAMMALS; AS HIGH CALORIE FOOD, ANTICHOLESTEROL AGENTS, ANTIISHEMIC AGENTS, ORGAN PRESERVATIVE, ANTIDIABETIC AGENTS CASE WESTERN RESERVE UNIVERSITY (US) 1999-03-02 US disclosed
EP-0888267-A1 NOVEL PYRUVATE COMPOUNDS AND METHODS FOR USE THEREOF CASE WESTERN RESERVE UNIVERSITY (US) 1999-01-07 EP disclosed
WO-1998051277-A1 MEDICAL USES OF PYRUVATES CASE WESTERN RESERVE UNIVERSITY (US) 1998-11-19 WO disclosed
WO-1997034856-A1 NOVEL PYRUVATE COMPOUNDS AND METHODS FOR USE THEREOF CASE WESTERN RESERVE UNIVERSITY (US) 1997-09-25 WO disclosed
US-5667962-A Pyruvate thiolester for the prevention of reperfusion injury CASE WESTERN RESERVE UNIVERSITY (US) 1997-09-16 US disclosed