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Compile Data Set for Download or QSAR

Found 9 hits with Last Name = 'hansen' and Initial = 'cl'   
Target/Host
(Institution)
LigandTarget/Host
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
Elastase


(Pseudomonas aeruginosa)
BDBM50498101
PNG
(CHEMBL3403862)
Show SMILES O=Cc1cccc(c1)-n1cc(CCC(=O)N[C@H]2CCOC2=O)nn1 |r|
Show InChI InChI=1S/C16H16N4O4/c21-10-11-2-1-3-13(8-11)20-9-12(18-19-20)4-5-15(22)17-14-6-7-24-16(14)23/h1-3,8-10,14H,4-7H2,(H,17,22)/t14-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.81E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498105
PNG
(CHEMBL3403858)
Show SMILES CCCCCCc1cn(CC(=O)N[C@H]2CCOC2=O)nn1 |r|
Show InChI InChI=1S/C14H22N4O3/c1-2-3-4-5-6-11-9-18(17-16-11)10-13(19)15-12-7-8-21-14(12)20/h9,12H,2-8,10H2,1H3,(H,15,19)/t12-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.25E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498098
PNG
(CHEMBL3403859)
Show SMILES O=C(Cn1cc(nn1)C1CC1)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C11H14N4O3/c16-10(12-8-3-4-18-11(8)17)6-15-5-9(13-14-15)7-1-2-7/h5,7-8H,1-4,6H2,(H,12,16)/t8-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.99E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498104
PNG
(CHEMBL3403865)
Show SMILES O=C(Cn1cc(nn1)-c1ccsc1)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C12H12N4O3S/c17-11(13-9-1-3-19-12(9)18)6-16-5-10(14-15-16)8-2-4-20-7-8/h2,4-5,7,9H,1,3,6H2,(H,13,17)/t9-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 5.82E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498097
PNG
(CHEMBL3403860)
Show SMILES O=C(Cn1cc(nn1)C1CCCC1)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C13H18N4O3/c18-12(14-10-5-6-20-13(10)19)8-17-7-11(15-16-17)9-3-1-2-4-9/h7,9-10H,1-6,8H2,(H,14,18)/t10-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.10E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498102
PNG
(CHEMBL3403856)
Show SMILES CCCc1cn(CC(=O)N[C@H]2CCOC2=O)nn1 |r|
Show InChI InChI=1S/C11H16N4O3/c1-2-3-8-6-15(14-13-8)7-10(16)12-9-4-5-18-11(9)17/h6,9H,2-5,7H2,1H3,(H,12,16)/t9-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.78E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498100
PNG
(CHEMBL3403864)
Show SMILES O=C(Cn1cc(CSc2ccccc2)nn1)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C15H16N4O3S/c20-14(16-13-6-7-22-15(13)21)9-19-8-11(17-18-19)10-23-12-4-2-1-3-5-12/h1-5,8,13H,6-7,9-10H2,(H,16,20)/t13-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.92E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498103
PNG
(CHEMBL3403861)
Show SMILES O=C(Cn1cc(nn1)C1CCCCC1)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C14H20N4O3/c19-13(15-11-6-7-21-14(11)20)9-18-8-12(16-17-18)10-4-2-1-3-5-10/h8,10-11H,1-7,9H2,(H,15,19)/t11-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 8.89E+5n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair
Elastase


(Pseudomonas aeruginosa)
BDBM50498099
PNG
(CHEMBL3403868)
Show SMILES [N-]=[N+]=Nc1ccc(cc1)C(=O)N[C@H]1CCOC1=O |r|
Show InChI InChI=1S/C11H10N4O3/c12-15-14-8-3-1-7(2-4-8)10(16)13-9-5-6-18-11(9)17/h1-4,9H,5-6H2,(H,13,16)/t9-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+6n/an/an/an/an/an/a



Technical University of Denmark

Curated by ChEMBL


Assay Description
Antagonist activity at lasB in Pseudomonas aeruginosa harboring lasB-gfp gene assessed as inhibition of 3-oxo-C6-HSL-induced quorum sensing by green ...


Bioorg Med Chem 23: 1638-50 (2015)


Article DOI: 10.1016/j.bmc.2015.01.038
BindingDB Entry DOI: 10.7270/Q2F192P6
More data for this
Ligand-Target Pair