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BDBM50190554 1-(4-tert-butyloxycarbamatebutyl)uracil::CHEMBL209787

SMILES: CC(C)(C)OC(=O)NCCCCn1ccc(=O)[nH]c1=O

InChI Key: InChIKey=BNKBZEZLTNUPAA-UHFFFAOYSA-N

Data: 2 KI

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 2 hits for monomerid = 50190554   
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
dUTP pyrophosphatase


(Plasmodium falciparum)
BDBM50190554
PNG
(1-(4-tert-butyloxycarbamatebutyl)uracil | CHEMBL20...)
Show SMILES CC(C)(C)OC(=O)NCCCCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H21N3O4/c1-13(2,3)20-12(19)14-7-4-5-8-16-9-6-10(17)15-11(16)18/h6,9H,4-5,7-8H2,1-3H3,(H,14,19)(H,15,17,18)
PDB
MMDB

KEGG

UniProtKB/TrEMBL

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

Similars

Article
PubMed
1.12E+5n/an/an/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of Plasmodium falciparum dUTPase


J Med Chem 49: 4183-95 (2006)


Article DOI: 10.1021/jm060126s
BindingDB Entry DOI: 10.7270/Q22J6BF0
More data for this
Ligand-Target Pair
Deoxyuridine 5'-triphosphate nucleotidohydrolase (dUTPase)


(Homo sapiens (Human))
BDBM50190554
PNG
(1-(4-tert-butyloxycarbamatebutyl)uracil | CHEMBL20...)
Show SMILES CC(C)(C)OC(=O)NCCCCn1ccc(=O)[nH]c1=O
Show InChI InChI=1S/C13H21N3O4/c1-13(2,3)20-12(19)14-7-4-5-8-16-9-6-10(17)15-11(16)18/h6,9H,4-5,7-8H2,1-3H3,(H,14,19)(H,15,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
>1.00E+6n/an/an/an/an/an/an/an/a



Cardiff University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant dUTPase


J Med Chem 49: 4183-95 (2006)


Article DOI: 10.1021/jm060126s
BindingDB Entry DOI: 10.7270/Q22J6BF0
More data for this
Ligand-Target Pair