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Compile Data Set for Download or QSAR

Found 10 hits of ki data for polymerid = 50005729,50006574   
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-1


(Bos taurus)
BDBM50375814
PNG
(CHEMBL260628)
Show SMILES CN(CCC[C@H](N)C(O)=O)C(NO)N=O |r|
Show InChI InChI=1S/C7H16N4O4/c1-11(7(9-14)10-15)4-2-3-5(8)6(12)13/h5,7,9,14H,2-4,8H2,1H3,(H,12,13)/t5-,7?/m0/s1
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PubMed
1.71E+4n/an/an/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of bovine liver arginase


Bioorg Med Chem 16: 2305-12 (2008)


Article DOI: 10.1016/j.bmc.2007.11.066
BindingDB Entry DOI: 10.7270/Q2KW5GXN
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50230418
PNG
(CHEMBL260629 | N(gamma)-hydroxy-L-arginine | N-OME...)
Show SMILES NC(NO)=NCCC[C@H]([NH3+])C([O-])=O |r,w:4.4|
Show InChI InChI=1S/C6H14N4O3/c7-4(5(11)12)2-1-3-9-6(8)10-13/h4,13H,1-3,7H2,(H,11,12)(H3,8,9,10)/t4-/m0/s1
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PubMed
3.00E+4n/an/an/an/an/an/an/an/a



Christian-Albrechts-University of Kiel

Curated by ChEMBL


Assay Description
Inhibition of bovine liver arginase


Bioorg Med Chem 16: 2305-12 (2008)


Article DOI: 10.1016/j.bmc.2007.11.066
BindingDB Entry DOI: 10.7270/Q2KW5GXN
More data for this
Ligand-Target Pair
Arginase-1


(Rattus norvegicus)
BDBM50354832
PNG
(CHEMBL1834160)
Show SMILES N[C@@H](CCCCC=O)C(O)=O |r|
Show InChI InChI=1S/C7H13NO3/c8-6(7(10)11)4-2-1-3-5-9/h5-6H,1-4,8H2,(H,10,11)/t6-/m0/s1
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6.00E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50553165
PNG
(CHEMBL4754674)
Show SMILES Oc1ccc(CNc2ccc(O)c(O)c2)cc1O
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8.20E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed type inhibition of recombinant bovine liver ARGI using L-arginine as substrate incubated for 60 mins by Dixon plot analysis


Citation and Details

Article DOI: 10.1039/d0md00011f
BindingDB Entry DOI: 10.7270/Q261140V
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50553165
PNG
(CHEMBL4754674)
Show SMILES Oc1ccc(CNc2ccc(O)c(O)c2)cc1O
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8.20E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed type inhibition of recombinant bovine liver ARGI using L-arginine as substrate incubated for 60 mins by Lineweaver-Burk plot analysis


Citation and Details

Article DOI: 10.1039/d0md00011f
BindingDB Entry DOI: 10.7270/Q261140V
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50553165
PNG
(CHEMBL4754674)
Show SMILES Oc1ccc(CNc2ccc(O)c(O)c2)cc1O
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8.20E+4n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed type inhibition of recombinant bovine liver ARGI using L-arginine as substrate incubated for 60 mins by Cornish-Bowden plot analysis


Citation and Details

Article DOI: 10.1039/d0md00011f
BindingDB Entry DOI: 10.7270/Q261140V
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50608139
PNG
(CHEMBL5287570)
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9.00E+4n/an/an/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50045936
PNG
((E)-4-(3,5-dihydroxystyryl)benzene-1,2-diol | (E)-...)
Show SMILES Oc1cc(O)cc(\C=C\c2ccc(O)c(O)c2)c1
Show InChI InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+
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Article
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1.36E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed type inhibition of recombinant bovine liver ARGI using L-arginine as substrate incubated for 60 mins by Cornish-Bowden plot analysis


Citation and Details

Article DOI: 10.1039/d0md00011f
BindingDB Entry DOI: 10.7270/Q261140V
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50045936
PNG
((E)-4-(3,5-dihydroxystyryl)benzene-1,2-diol | (E)-...)
Show SMILES Oc1cc(O)cc(\C=C\c2ccc(O)c(O)c2)c1
Show InChI InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+
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Article
PubMed
1.36E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed type inhibition of recombinant bovine liver ARGI using L-arginine as substrate incubated for 60 mins by Dixon plot analysis


Citation and Details

Article DOI: 10.1039/d0md00011f
BindingDB Entry DOI: 10.7270/Q261140V
More data for this
Ligand-Target Pair
Arginase-1


(Bos taurus)
BDBM50045936
PNG
((E)-4-(3,5-dihydroxystyryl)benzene-1,2-diol | (E)-...)
Show SMILES Oc1cc(O)cc(\C=C\c2ccc(O)c(O)c2)c1
Show InChI InChI=1S/C14H12O4/c15-11-5-10(6-12(16)8-11)2-1-9-3-4-13(17)14(18)7-9/h1-8,15-18H/b2-1+
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Article
PubMed
1.36E+5n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed type inhibition of recombinant bovine liver ARGI using L-arginine as substrate incubated for 60 mins by Lineweaver-Burk plot analysis


Citation and Details

Article DOI: 10.1039/d0md00011f
BindingDB Entry DOI: 10.7270/Q261140V
More data for this
Ligand-Target Pair