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BDBM50096612 CHEMBL3577284

SMILES: NC(=O)CNC(=O)Cn1c2C[C@@H](CCc2c2cc(Br)ccc12)C(O)=O

InChI Key: InChIKey=UUIXCDAYPAAGMW-SECBINFHSA-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
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50096612   
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 polymerase III subunit beta


(Escherichia coli (strain K12))
BDBM50096612
PNG
(CHEMBL3577284)
Show SMILES NC(=O)CNC(=O)Cn1c2C[C@@H](CCc2c2cc(Br)ccc12)C(O)=O |r|
Show InChI InChI=1S/C17H18BrN3O4/c18-10-2-4-13-12(6-10)11-3-1-9(17(24)25)5-14(11)21(13)8-16(23)20-7-15(19)22/h2,4,6,9H,1,3,5,7-8H2,(H2,19,22)(H,20,23)(H,24,25)/t9-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
9.50E+4n/an/an/an/an/an/an/an/a



The University of Wollongong and The Illawarra Health and Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli DNA sliding clamp protein using N-fluorescein (FAM)-QLDLF-OH tracer by fluorescence polarization assay


J Med Chem 58: 4693-702 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00232
BindingDB Entry DOI: 10.7270/Q2KK9DJ9
More data for this
Ligand-Target Pair
DNA polymerase III subunit beta


(Escherichia coli (strain K12))
BDBM50096612
PNG
(CHEMBL3577284)
Show SMILES NC(=O)CNC(=O)Cn1c2C[C@@H](CCc2c2cc(Br)ccc12)C(O)=O |r|
Show InChI InChI=1S/C17H18BrN3O4/c18-10-2-4-13-12(6-10)11-3-1-9(17(24)25)5-14(11)21(13)8-16(23)20-7-15(19)22/h2,4,6,9H,1,3,5,7-8H2,(H2,19,22)(H,20,23)(H,24,25)/t9-/m1/s1
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.71E+5n/an/an/an/an/an/a



The University of Wollongong and The Illawarra Health and Medical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Escherichia coli DNA sliding clamp protein using N-fluorescein (FAM)-QLDLF-OH tracer by fluorescence polarization assay


J Med Chem 58: 4693-702 (2015)


Article DOI: 10.1021/acs.jmedchem.5b00232
BindingDB Entry DOI: 10.7270/Q2KK9DJ9
More data for this
Ligand-Target Pair