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Compile Data Set for Download or QSAR

Found 27 hits with Last Name = 'ludes-meyers' and Initial = 'jh'   
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
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572440
PNG
(CHEMBL4469438)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3ccccc23)nc2cc(CN)ccc12
PDB
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n/an/a 0.400n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572444
PNG
(CHEMBL4878302)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3ccc(F)cc23)nc2cc(CN)ccc12
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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572466
PNG
(CHEMBL4876200)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CCOCC3)c3ccccc23)nc2cc(CN)ccc12
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n/an/a 0.690n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus fusion protein


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572442
PNG
(CHEMBL4872095)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3cc(F)ccc23)nc2cc(CN)ccc12
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n/an/a 0.700n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572464
PNG
(CHEMBL4858040)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3ccncc23)nc2cc(CN)ccc12
PDB
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n/an/a 0.900n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus fusion protein


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572450
PNG
(Rv-521 | Rv521 | Sisunatovir)
Show SMILES NCc1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
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n/an/a 0.900n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572463
PNG
(CHEMBL4871101)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3cccnc23)nc2cc(CN)ccc12
PDB
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n/an/a 0.900n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus fusion protein


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572451
PNG
(CHEMBL4867108)
Show SMILES NCc1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4cccc(F)c34)nc2c1
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572465
PNG
(CHEMBL4858949)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CN(C3)C(C)=O)c3ccccc23)nc2cc(CN)ccc12
PDB
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n/an/a 1.10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus fusion protein


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572445
PNG
(CHEMBL4865906)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3ccc(Cl)cc23)nc2cc(CN)ccc12
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n/an/a 1.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572453
PNG
(CHEMBL4874709)
Show SMILES NCc1ccc2n(C3CCOCC3)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
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n/an/a 1.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572447
PNG
(CHEMBL4860271)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3cccc(F)c23)nc2cc(CN)ccc12
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n/an/a 1.30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572449
PNG
(CHEMBL4853602)
Show SMILES NCc1ccc2n(CCCCO)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
PDB
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n/an/a 1.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572448
PNG
(CHEMBL4863172)
Show SMILES CS(=O)(=O)CCCn1c(CN2C(=O)C3(CC3)c3ccc(F)cc23)nc2cc(CN)ccc12
PDB
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n/an/a 2.60n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572452
PNG
(CHEMBL4873528)
Show SMILES NCc1ccc2n(C3CCC(O)CC3)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1 |(23.93,-12.4,;22.59,-11.64,;21.26,-12.41,;21.26,-13.96,;19.93,-14.74,;18.59,-13.97,;17.13,-14.45,;16.66,-15.91,;15.16,-16.23,;14.69,-17.69,;15.72,-18.84,;15.24,-20.3,;17.23,-18.52,;17.7,-17.05,;16.22,-13.21,;14.68,-13.21,;13.91,-11.88,;14.52,-10.48,;16.02,-10.15,;13.36,-9.45,;12.58,-8.11,;14.13,-8.11,;12.04,-10.23,;10.58,-9.76,;9.44,-10.79,;9.77,-12.3,;8.64,-13.34,;11.23,-12.76,;12.37,-11.73,;17.12,-11.96,;18.59,-12.43,;19.92,-11.65,)|
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n/an/a 2.60n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572454
PNG
(CHEMBL4855358)
Show SMILES NC(=N)c1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
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n/an/a 3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572443
PNG
(CHEMBL4872263)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3cc(Cl)ccc23)nc2cc(CN)ccc12
PDB
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n/an/a 4.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572462
PNG
(CHEMBL4876843)
Show SMILES Fc1ccc2c(c1)N(Cc1nc3cc(Cl)ccc3n1CCCC(F)(F)F)C(=O)C21CC1
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n/an/a 6.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572441
PNG
(CHEMBL4862291)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3c2cccc3Cl)nc2cc(CN)ccc12
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n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572461
PNG
(CHEMBL4859694)
Show SMILES Fc1ccc2c(c1)N(Cc1nc3ccccc3n1CCCC(F)(F)F)C(=O)C21CC1
PDB
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n/an/a 37n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572446
PNG
(CHEMBL4878086)
Show SMILES CC(C)CCn1c(CN2C(=O)C3(CC3)c3cccc(Cl)c23)nc2cc(CN)ccc12
PDB
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n/an/a 47n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572457
PNG
(CHEMBL4847062)
Show SMILES NC(=O)c1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
PDB
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n/an/a 71n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572456
PNG
(CHEMBL4866951)
Show SMILES NC(=N)NCc1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
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n/an/a 183n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572460
PNG
(CHEMBL4871056)
Show SMILES CC(=O)NCc1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
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n/an/a 365n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572455
PNG
(CHEMBL4869353)
Show SMILES CCNC(=N)c1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
PDB
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n/an/a 641n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572459
PNG
(CHEMBL4873987)
Show SMILES CS(=O)(=O)c1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
PDB
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n/an/a 1.07E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair
Fusion glycoprotein F0


(Human respiratory syncytial virus A (strain A2))
BDBM50572458
PNG
(CHEMBL4878851)
Show SMILES OC(=O)c1ccc2n(CCCC(F)(F)F)c(CN3C(=O)C4(CC4)c4ccc(F)cc34)nc2c1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of Respiratory syncytial virus A2 fusion protein expressed in HEK293T cells harboring GAL4-NF-kappaB assessed as reduction in cell-cell fu...


Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c01882
BindingDB Entry DOI: 10.7270/Q2QF8XNB
More data for this
Ligand-Target Pair