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Compile Data Set for Download or QSAR

Found 9 hits with Last Name = 'feitosa' and Initial = 'lm'   
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)
BDBM50510706
PNG
(CHEMBL4515068)
Show SMILES Cc1cc(NNC(N)=S)n2nc(nc2n1)C(F)(F)F
Show InChI InChI=1S/C8H8F3N7S/c1-3-2-4(15-16-6(12)19)18-7(13-3)14-5(17-18)8(9,10)11/h2,15H,1H3,(H3,12,16,19)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
1.70E+4n/an/an/an/an/an/an/an/a



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Non-competitive inhibition of Leishmania amazonensis arginase using L-arginine as substrate incubated for 15 mins


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510709
PNG
(CHEMBL4571367)
Show SMILES NC(=S)NNc1ncnc2n(ncc12)-c1ccccc1
Show InChI InChI=1S/C12H11N7S/c13-12(20)18-17-10-9-6-16-19(11(9)15-7-14-10)8-4-2-1-3-5-8/h1-7H,(H3,13,18,20)(H,14,15,17)
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



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510706
PNG
(CHEMBL4515068)
Show SMILES Cc1cc(NNC(N)=S)n2nc(nc2n1)C(F)(F)F
Show InChI InChI=1S/C8H8F3N7S/c1-3-2-4(15-16-6(12)19)18-7(13-3)14-5(17-18)8(9,10)11/h2,15H,1H3,(H3,12,16,19)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.65E+4n/an/an/an/an/an/a



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Non-competitive inhibition of Leishmania amazonensis arginase using L-arginine as substrate incubated for 15 mins


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510706
PNG
(CHEMBL4515068)
Show SMILES Cc1cc(NNC(N)=S)n2nc(nc2n1)C(F)(F)F
Show InChI InChI=1S/C8H8F3N7S/c1-3-2-4(15-16-6(12)19)18-7(13-3)14-5(17-18)8(9,10)11/h2,15H,1H3,(H3,12,16,19)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.65E+4n/an/an/an/an/an/a



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510711
PNG
(CHEMBL4467463)
Show SMILES NC(=S)NNc1ncnc2n(ncc12)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C13H10F3N7S/c14-13(15,16)7-1-3-8(4-2-7)23-11-9(5-20-23)10(18-6-19-11)21-22-12(17)24/h1-6H,(H3,17,22,24)(H,18,19,21)
PDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.70E+4n/an/an/an/an/an/a



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510707
PNG
(CHEMBL4541649)
Show SMILES NC(=S)NNc1ncnc2n(ncc12)-c1ccc(cc1)C#N
Show InChI InChI=1S/C13H10N8S/c14-5-8-1-3-9(4-2-8)21-12-10(6-18-21)11(16-7-17-12)19-20-13(15)22/h1-4,6-7H,(H3,15,20,22)(H,16,17,19)
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



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510708
PNG
(CHEMBL4456185)
Show SMILES Cc1ccc(cc1)-n1ncc2c(NNC(N)=S)ncnc12
Show InChI InChI=1S/C13H13N7S/c1-8-2-4-9(5-3-8)20-12-10(6-17-20)11(15-7-16-12)18-19-13(14)21/h2-7H,1H3,(H3,14,19,21)(H,15,16,18)
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



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510712
PNG
(CHEMBL4570250)
Show SMILES NC(=S)NNc1ncnc2n(ncc12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C12H10ClN7S/c13-7-1-3-8(4-2-7)20-11-9(5-17-20)10(15-6-16-11)18-19-12(14)21/h1-6H,(H3,14,19,21)(H,15,16,18)
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



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair
Arginase


(Leishmania amazonensis)
BDBM50510710
PNG
(CHEMBL4438412)
Show SMILES NC(=S)NNc1ncnc2n(ncc12)-c1ccc(F)cc1
Show InChI InChI=1S/C12H10FN7S/c13-7-1-3-8(4-2-7)20-11-9(5-17-20)10(15-6-16-11)18-19-12(14)21/h1-6H,(H3,14,19,21)(H,15,16,18)
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



Instituto de Tecnologia em Farmacos

Curated by ChEMBL


Assay Description
Inhibition of recombinant Leishmania amazonensis arginase expressed in Escherichia coli using L-arginine as substrate


Bioorg Med Chem 27: 3061-3069 (2019)


Article DOI: 10.1016/j.bmc.2019.05.026
BindingDB Entry DOI: 10.7270/Q2SX6HJQ
More data for this
Ligand-Target Pair