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Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'CviR transcriptional regulator'   
Target
(Institution)
LigandTarget
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50351516
PNG
(CHEMBL1823953)
Show SMILES Clc1ccc(OCCCC(=O)NC2CCOC2=O)cc1
Show InChI InChI=1S/C14H16ClNO4/c15-10-3-5-11(6-4-10)19-8-1-2-13(17)16-12-7-9-20-14(12)18/h3-6,12H,1-2,7-9H2,(H,16,17)
PDB
MMDB

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

Patents

AffyNet 
PDB
Article
PubMed
n/an/a 377n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Inhibition of Chromobacterium violaceum CviR-dependent GFP fluorescence in Escherichia coli


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50136221
PNG
(CHEMBL3754734)
Show SMILES O=C(COc1ccc(cc1)C1=NCCN1)Nc1ccccc1
Show InChI InChI=1S/C17H17N3O2/c21-16(20-14-4-2-1-3-5-14)12-22-15-8-6-13(7-9-15)17-18-10-11-19-17/h1-9H,10-12H2,(H,18,19)(H,20,21)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 6.61E+4n/an/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Inhibition of CviR in Chromobacterium violaceum CV026 assessed as reduction of violacein production after 15 hrs


Bioorg Med Chem 23: 7565-77 (2015)

More data for this
Ligand-Target Pair
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50136219
PNG
(CHEMBL3753564)
Show SMILES CCCCCCOc1ccc(cc1)C1=NCCN1
Show InChI InChI=1S/C15H22N2O/c1-2-3-4-5-12-18-14-8-6-13(7-9-14)15-16-10-11-17-15/h6-9H,2-5,10-12H2,1H3,(H,16,17)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 9.09E+4n/an/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Inhibition of CviR in Chromobacterium violaceum CV026 assessed as reduction of violacein production after 15 hrs


Bioorg Med Chem 23: 7565-77 (2015)

More data for this
Ligand-Target Pair
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50136296
PNG
(CHEMBL3754531)
Show SMILES CCCCCCOc1ccc(cc1)C1=NCCO1
Show InChI InChI=1S/C15H21NO2/c1-2-3-4-5-11-17-14-8-6-13(7-9-14)15-16-10-12-18-15/h6-9H,2-5,10-12H2,1H3
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
AffyNet 
PubMed
n/an/a 9.74E+4n/an/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Inhibition of CviR in Chromobacterium violaceum CV026 assessed as reduction of violacein production after 15 hrs


Bioorg Med Chem 23: 7565-77 (2015)

More data for this
Ligand-Target Pair
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50136220
PNG
(CHEMBL3752577)
Show SMILES COc1ccc(NC(=O)COc2ccc(cc2)C2=NCCN2)cc1
Show InChI InChI=1S/C18H19N3O3/c1-23-15-8-4-14(5-9-15)21-17(22)12-24-16-6-2-13(3-7-16)18-19-10-11-20-18/h2-9H,10-12H2,1H3,(H,19,20)(H,21,22)
PDB
MMDB

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GoogleScholar
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PC sid
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PubMed
n/an/a 3.41E+5n/an/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Inhibition of CviR in Chromobacterium violaceum CV026 assessed as reduction of violacein production after 15 hrs


Bioorg Med Chem 23: 7565-77 (2015)

More data for this
Ligand-Target Pair
CviR transcriptional regulator


(Chromobacterium violaceum)
BDBM50136222
PNG
(CHEMBL3754036)
Show SMILES O=C(Cc1ccccc1)NC1=NCCS1
Show InChI InChI=1S/C11H12N2OS/c14-10(13-11-12-6-7-15-11)8-9-4-2-1-3-5-9/h1-5H,6-8H2,(H,12,13,14)
PDB
MMDB

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

AffyNet 
PubMed
n/an/a 6.70E+5n/an/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Inhibition of CviR in Chromobacterium violaceum CV026 assessed as reduction of violacein production after 15 hrs


Bioorg Med Chem 23: 7565-77 (2015)

More data for this
Ligand-Target Pair