Oxamate

Oxamate

SCHEMBL5710751

NC(=O)C(=O)O.O=C(O)O

nearest known ligand 0.90

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Oxamate. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LDHA P00338 2/20 0.90
LDHB P07195 1/20 0.90
ACHE P22303 1/20 0.55
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
CA1 P00915 1/20 0.50
LMNA P02545 5/20 0.46
TDP1 Q9NUW8 4/20 0.46
ALDH1A1 P00352 4/20 0.46
OR51E2 Q9H255 2/20 0.46
BLM P54132 5/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
PMP22 Q01453 4/20 0.39
ALOX15 P16050 2/20 0.39
CYP3A4 P08684 4/20 0.33
TSHR P16473 4/20 0.33
HSD17B10 Q99714 3/20 0.33
NFKB1 P19838 2/20 0.33
HPGD P15428 2/20 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
Oxamate SCHEMBL2109206 0.95 LDHA (1.00) LDHALDHBACHECA2CA9
Oxamate SCHEMBL11620 0.95
Oxamate SCHEMBL4394181 0.90
Oxamate SCHEMBL3888428 0.90
Oxamate SCHEMBL28760846 0.90
Oxamate SCHEMBL1258135 0.90
Oxamate SCHEMBL2558688 0.90
Oxamate SCHEMBL2541414 0.90
Oxamate SCHEMBL7757988 0.90 LDHA (0.90) LDHALDHBACHECA2CA9
Oxamate SCHEMBL29210043 0.90

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
EP-1717228-A1 Sulfonylamino(thio)carbonylderivatives as herbicides or plant growth regulators Bayer CropScience GmbH (DE) 2006-11-02 EP disclosed