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BDBM50022154 6-Benzylamino-1H-pyrimidine-2,4-dione::CHEMBL86482

SMILES: O=c1cc(NCc2ccccc2)[nH]c(=O)[nH]1

InChI Key: InChIKey=NORSBFZJRBPBQZ-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50022154   
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
DNA topoisomerase III


(Bacillus subtilis)
BDBM50022154
PNG
(6-Benzylamino-1H-pyrimidine-2,4-dione | CHEMBL8648...)
Show SMILES O=c1cc(NCc2ccccc2)[nH]c(=O)[nH]1
Show InChI InChI=1S/C11H11N3O2/c15-10-6-9(13-11(16)14-10)12-7-8-4-2-1-3-5-8/h1-6H,7H2,(H3,12,13,14,15,16)
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem

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Similars

PubMed
7.50E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Concentration producing 50% inhibition of Bacillus subtilis DNA topoisomerase III in the presence of dGTP using DNA Polymerase assay


J Med Chem 29: 676-81 (1986)


BindingDB Entry DOI: 10.7270/Q2MP528D
More data for this
Ligand-Target Pair
Thymidine Phosphorylase (TP)


(Homo sapiens (Human))
BDBM50022154
PNG
(6-Benzylamino-1H-pyrimidine-2,4-dione | CHEMBL8648...)
Show SMILES O=c1cc(NCc2ccccc2)[nH]c(=O)[nH]1
Show InChI InChI=1S/C11H11N3O2/c15-10-6-9(13-11(16)14-10)12-7-8-4-2-1-3-5-8/h1-6H,7H2,(H3,12,13,14,15,16)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Istituto di Genetica Biochimica ed Evoluzionistica

Curated by ChEMBL


Assay Description
Inhibition of catabolic activity of human thymidine phosphorylase


J Med Chem 43: 2601-7 (2000)


BindingDB Entry DOI: 10.7270/Q2639P06
More data for this
Ligand-Target Pair