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BDBM46100 6-hydroxy-2,4-diketo-N-phenyl-1H-pyrimidine-5-carboxamide::6-hydroxy-2,4-dioxo-N-phenyl-1H-pyrimidine-5-carboxamide::6-oxidanyl-2,4-bis(oxidanylidene)-N-phenyl-1H-pyrimidine-5-carboxamide::UPDDI-00294852::US9428466, 2-oxo-desthiomerbarone::cid_100782

SMILES: Oc1[nH]c(=O)[nH]c(=O)c1C(=O)Nc1ccccc1

InChI Key: InChIKey=VKWYRWQIBQMDFJ-UHFFFAOYSA-N

Data: 3 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 46100   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Serine/threonine-protein kinase PLK1


(Homo sapiens (Human))
BDBM46100
PNG
(6-hydroxy-2,4-diketo-N-phenyl-1H-pyrimidine-5-carb...)
Show SMILES Oc1[nH]c(=O)[nH]c(=O)c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C11H9N3O4/c15-8(12-6-4-2-1-3-5-6)7-9(16)13-11(18)14-10(7)17/h1-5H,(H,12,15)(H3,13,14,16,17,18)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Pittsburgh Molecular Library Screening Center

Curated by PubChem BioAssay


Assay Description
List of compounds to be tested: 33 component starting materials and chemical analogs of the hits identified in the in vitro PLK1-PBD binding primary ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q280511V
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Homo sapiens (Human))
BDBM46100
PNG
(6-hydroxy-2,4-diketo-N-phenyl-1H-pyrimidine-5-carb...)
Show SMILES Oc1[nH]c(=O)[nH]c(=O)c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C11H9N3O4/c15-8(12-6-4-2-1-3-5-6)7-9(16)13-11(18)14-10(7)17/h1-5H,(H,12,15)(H3,13,14,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

US Patent
n/an/a>3.00E+5n/an/an/an/an/an/a



TBA

US Patent


Assay Description
Xanthine oxidase inhibition was determined using a standard fluorescence-based assay for xanthine oxidase activity (McHale A, Grimes H, Coughlan M P:...


US Patent US9428466 (2016)


BindingDB Entry DOI: 10.7270/Q22J69RM
More data for this
Ligand-Target Pair
Solute carrier family 22 member 12


(Homo sapiens (Human))
BDBM46100
PNG
(6-hydroxy-2,4-diketo-N-phenyl-1H-pyrimidine-5-carb...)
Show SMILES Oc1[nH]c(=O)[nH]c(=O)c1C(=O)Nc1ccccc1
Show InChI InChI=1S/C11H9N3O4/c15-8(12-6-4-2-1-3-5-6)7-9(16)13-11(18)14-10(7)17/h1-5H,(H,12,15)(H3,13,14,16,17,18)
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

US Patent
n/an/a 1.20E+3n/an/an/an/an/an/a



TBA

US Patent


Assay Description
URAT1 (SLC22A12) activity was evaluated in a cellular uptake assay using a 96-well plate with stably transfected URAT-1/CHO cells. 3H-orotate was use...


US Patent US9428466 (2016)


BindingDB Entry DOI: 10.7270/Q22J69RM
More data for this
Ligand-Target Pair