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Compile Data Set for Download or QSAR

Found 10 hits with Last Name = 'farias' and Initial = 'ab'   
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
Arginase


(Leishmania amazonensis)
BDBM50521944
PNG
(CHEMBL4204512)
Show SMILES CC(=O)Nc1ccc(C)cc1C(F)(F)C(=O)NNc1ccccc1
Show InChI InChI=1S/C17H17F2N3O2/c1-11-8-9-15(20-12(2)23)14(10-11)17(18,19)16(24)22-21-13-6-4-3-5-7-13/h3-10,21H,1-2H3,(H,20,23)(H,22,24)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.30E+3n/an/an/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production by measu...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521942
PNG
(CHEMBL4216180)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NNc1ccccc1
Show InChI InChI=1S/C16H15F2N3O2/c1-11(22)19-14-10-6-5-9-13(14)16(17,18)15(23)21-20-12-7-3-2-4-8-12/h2-10,20H,1H3,(H,19,22)(H,21,23)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
5.10E+3n/an/an/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production by measu...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521943
PNG
(CHEMBL4574177)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NNc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H14F5N3O2/c1-10(26)23-14-5-3-2-4-13(14)16(18,19)15(27)25-24-12-8-6-11(7-9-12)17(20,21)22/h2-9,24H,1H3,(H,23,26)(H,25,27)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
2.60E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production by measu...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521947
PNG
(CHEMBL4530523)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NCc1ccccc1
Show InChI InChI=1S/C17H16F2N2O2/c1-12(22)21-15-10-6-5-9-14(15)17(18,19)16(23)20-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,20,23)(H,21,22)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
3.20E+4n/an/an/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production by measu...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521944
PNG
(CHEMBL4204512)
Show SMILES CC(=O)Nc1ccc(C)cc1C(F)(F)C(=O)NNc1ccccc1
Show InChI InChI=1S/C17H17F2N3O2/c1-11-8-9-15(20-12(2)23)14(10-11)17(18,19)16(24)22-21-13-6-4-3-5-7-13/h3-10,21H,1-2H3,(H,20,23)(H,22,24)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521942
PNG
(CHEMBL4216180)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NNc1ccccc1
Show InChI InChI=1S/C16H15F2N3O2/c1-11(22)19-14-10-6-5-9-13(14)16(17,18)15(23)21-20-12-7-3-2-4-8-12/h2-10,20H,1H3,(H,19,22)(H,21,23)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521947
PNG
(CHEMBL4530523)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NCc1ccccc1
Show InChI InChI=1S/C17H16F2N2O2/c1-12(22)21-15-10-6-5-9-14(15)17(18,19)16(23)20-11-13-7-3-2-4-8-13/h2-10H,11H2,1H3,(H,20,23)(H,21,22)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.70E+4n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521943
PNG
(CHEMBL4574177)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NNc1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C17H14F5N3O2/c1-10(26)23-14-5-3-2-4-13(14)16(18,19)15(27)25-24-12-8-6-11(7-9-12)17(20,21)22/h2-9,24H,1H3,(H,23,26)(H,25,27)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.80E+4n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521946
PNG
(CHEMBL4211729)
Show SMILES CC(=O)Nc1ccccc1C(F)(F)C(=O)NNc1ccccn1
Show InChI InChI=1S/C15H14F2N4O2/c1-10(22)19-12-7-3-2-6-11(12)15(16,17)14(23)21-20-13-8-4-5-9-18-13/h2-9H,1H3,(H,18,20)(H,19,22)(H,21,23)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50521945
PNG
(CHEMBL4216693)
Show SMILES CC(=O)Nc1ccc(C)cc1C(F)(F)C(=O)NNc1ccccn1
Show InChI InChI=1S/C16H16F2N4O2/c1-10-6-7-13(20-11(2)23)12(9-10)16(17,18)15(24)22-21-14-5-3-4-8-19-14/h3-9H,1-2H3,(H,19,21)(H,20,23)(H,22,24)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universidade Federal do Rio de Janeiro

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli assessed as reduction in urea production using L-arginine as ...


Bioorg Med Chem 27: 3853-3859 (2019)


Article DOI: 10.1016/j.bmc.2019.07.022
BindingDB Entry DOI: 10.7270/Q27D2ZJF
More data for this
Ligand-Target Pair