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Compile Data Set for Download or QSAR

Found 8 hits with Last Name = 'falsitta' and Initial = 'l'   
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
ATP-dependent RNA helicase DDX1


(Homo sapiens (Human))
BDBM50537055
PNG
(CHEMBL4591917)
Show SMILES CCCCc1cn(nn1)-c1cccc(c1)S(=O)(=O)Nc1cccc2cnccc12
Show InChI InChI=1S/C21H21N5O2S/c1-2-3-7-17-15-26(25-23-17)18-8-5-9-19(13-18)29(27,28)24-21-10-4-6-16-14-22-12-11-20(16)21/h4-6,8-15,24H,2-3,7H2,1H3
PDB

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UniProtKB/SwissProt

antibodypedia
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PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX1 helicase activity


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX1


(Homo sapiens (Human))
BDBM50537056
PNG
(CHEMBL4571759)
Show SMILES CCCCc1cn(nn1)-c1cccc(c1)S(=O)(=O)Nc1ccccc1C(F)(F)F
Show InChI InChI=1S/C19H19F3N4O2S/c1-2-3-7-14-13-26(25-23-14)15-8-6-9-16(12-15)29(27,28)24-18-11-5-4-10-17(18)19(20,21)22/h4-6,8-13,24H,2-3,7H2,1H3
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX1 helicase activity


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))
BDBM50537055
PNG
(CHEMBL4591917)
Show SMILES CCCCc1cn(nn1)-c1cccc(c1)S(=O)(=O)Nc1cccc2cnccc12
Show InChI InChI=1S/C21H21N5O2S/c1-2-3-7-17-15-26(25-23-17)18-8-5-9-19(13-18)29(27,28)24-21-10-4-6-16-14-22-12-11-20(16)21/h4-6,8-15,24H,2-3,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX3X ATPase activity using DDX3 as substrate by ADP-Glo kinase assay


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))
BDBM50537058
PNG
(CHEMBL4531719)
Show SMILES CCCCc1cn(nn1)-c1ccc(NC(=O)Nc2ccccc2C)cc1
Show InChI InChI=1S/C20H23N5O/c1-3-4-8-17-14-25(24-23-17)18-12-10-16(11-13-18)21-20(26)22-19-9-6-5-7-15(19)2/h5-7,9-14H,3-4,8H2,1-2H3,(H2,21,22,26)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
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MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX3X ATPase activity using DDX3 as substrate by ADP-Glo kinase assay


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))
BDBM50537057
PNG
(CHEMBL4551611)
Show SMILES Oc1ccccc1NS(=O)(=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C12H10N2O5S/c15-12-7-2-1-6-11(12)13-20(18,19)10-5-3-4-9(8-10)14(16)17/h1-8,13,15H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX3X ATPase activity using DDX3 as substrate by ADP-Glo kinase assay


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX1


(Homo sapiens (Human))
BDBM50537058
PNG
(CHEMBL4531719)
Show SMILES CCCCc1cn(nn1)-c1ccc(NC(=O)Nc2ccccc2C)cc1
Show InChI InChI=1S/C20H23N5O/c1-3-4-8-17-14-25(24-23-17)18-12-10-16(11-13-18)21-20(26)22-19-9-6-5-7-15(19)2/h5-7,9-14H,3-4,8H2,1-2H3,(H2,21,22,26)
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX1 helicase activity


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX1


(Homo sapiens (Human))
BDBM50537057
PNG
(CHEMBL4551611)
Show SMILES Oc1ccccc1NS(=O)(=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C12H10N2O5S/c15-12-7-2-1-6-11(12)13-20(18,19)10-5-3-4-9(8-10)14(16)17/h1-8,13,15H
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX1 helicase activity


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))
BDBM50537056
PNG
(CHEMBL4571759)
Show SMILES CCCCc1cn(nn1)-c1cccc(c1)S(=O)(=O)Nc1ccccc1C(F)(F)F
Show InChI InChI=1S/C19H19F3N4O2S/c1-2-3-7-14-13-26(25-23-14)15-8-6-9-16(12-15)29(27,28)24-18-11-5-4-10-17(18)19(20,21)22/h4-6,8-13,24H,2-3,7H2,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX3X ATPase activity using DDX3 as substrate by ADP-Glo kinase assay


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
BindingDB Entry DOI: 10.7270/Q2X06BJK
More data for this
Ligand-Target Pair