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PubMed code 10969988

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
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
Arginine--tRNA ligase, cytoplasmic


(Homo sapiens (Human))		BDBM50091515
PNG
(Aminoalkyl adenylate and aminoacyl sulfamate analo...)
Show SMILES N[C@@H](CCCNC(N)=[NH2+])C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C16H26N10O7S/c17-7(2-1-3-21-16(19)20)14(29)25-34(30,31)32-4-8-10(27)11(28)15(33-8)26-6-24-9-12(18)22-5-23-13(9)26/h5-8,10-11,15,27-28H,1-4,17H2,(H,25,29)(H2,18,22,23)(H4,19,20,21)/p+1/t7-,8+,10+,11+,15+/m0/s1
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n/an/a 4.5n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against cognate Staphylococcus aureus Arginyl-tRNA synthetase

Bioorg Med Chem Lett 10: 1871-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TX3FWJ
More data for this
Ligand-Target Pair
Arginine--tRNA ligase, cytoplasmic


(Homo sapiens (Human))		BDBM50091518
PNG
(CHEMBL434782 | Phosphoric acid (S)-2-amino-5-guani...)
Show SMILES N[C@@H](CCCNC(N)=[NH2+])COP([O-])(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C16H28N9O7P/c17-8(2-1-3-21-16(19)20)4-30-33(28,29)31-5-9-11(26)12(27)15(32-9)25-7-24-10-13(18)22-6-23-14(10)25/h6-9,11-12,15,26-27H,1-5,17H2,(H,28,29)(H2,18,22,23)(H4,19,20,21)/t8-,9+,11+,12+,15+/m0/s1
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n/an/a 7.5n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against cognate Staphylococcus aureus Arginyl-tRNA synthetase

Bioorg Med Chem Lett 10: 1871-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TX3FWJ
More data for this
Ligand-Target Pair
Threonine--tRNA ligase 1, cytoplasmic


(Homo sapiens (Human))		BDBM50366646
PNG
(CHEMBL1163068)
Show SMILES C[C@@H](O)[C@H](N)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12 |r|
Show InChI InChI=1S/C14H21N7O8S/c1-5(22)7(15)13(25)20-30(26,27)28-2-6-9(23)10(24)14(29-6)21-4-19-8-11(16)17-3-18-12(8)21/h3-7,9-10,14,22-24H,2,15H2,1H3,(H,20,25)(H2,16,17,18)/t5-,6-,7+,9-,10-,14-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against cognate Staphylococcus aureus threonyl tRNA synthetase

Bioorg Med Chem Lett 10: 1871-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TX3FWJ
More data for this
Ligand-Target Pair
Histidine--tRNA ligase, cytoplasmic


(Homo sapiens (Human))		BDBM50091516
PNG
(5'-O-[(L-HISTIDYLAMINO)SULFONYL]ADENOSINE | CHEMBL...)
Show SMILES N[C@@H](Cc1cnc[nH]1)C(=O)NS(=O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1cnc2c(N)ncnc12
Show InChI InChI=1S/C16H21N9O7S/c17-8(1-7-2-19-4-20-7)15(28)24-33(29,30)31-3-9-11(26)12(27)16(32-9)25-6-23-10-13(18)21-5-22-14(10)25/h2,4-6,8-9,11-12,16,26-27H,1,3,17H2,(H,19,20)(H,24,28)(H2,18,21,22)/t8-,9+,11+,12+,16+/m0/s1
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n/an/a 130n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory activity against cognate Staphylococcus aureus Histidyl-tRNA synthetase

Bioorg Med Chem Lett 10: 1871-4 (2000)


BindingDB Entry DOI: 10.7270/Q2TX3FWJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%