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There are 18 purchasable compounds for target: Aminoacyl-tRNA synthetase

Wt: 614.6
BDBM19
Purchase
Wt: 239.2
BDBM35453
Purchase
Wt: 402.4
BDBM43823
Purchase
Wt: 276.3
BDBM43824
Purchase
Wt: 405.1
BDBM43825
Wt: 462.5
BDBM43826
Purchase
Wt: 304.3
BDBM43827
Purchase
Wt: 328.1
BDBM50097094
Purchase
Wt: 250.2
BDBM50097097
Purchase
Wt: 289.7
BDBM50097098
Purchase
Wt: 249.2
BDBM50097100
Purchase
Wt: 454.0
BDBM50097082
Purchase
Wt: 318.1
BDBM50097083
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Wt: 356.2
BDBM50097088
Purchase
Wt: 362.6
BDBM50097090
Purchase
Displayed 1 to 15 (of 18 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 15 hits for monomerid = 19,35453,43823,43824,43825,43826,43827,50097094,50097097,50097098,50097100,50097082,50097083,50097088,50097090   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Aminoacyl-tRNA synthetase


(Thermus thermophilus)
BDBM19
PNG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
Show SMILES NC[C@@H]1O[C@H](O[C@@H]2[C@@H](CO)O[C@@H](O[C@@H]3[C@@H](O)[C@H](N)C[C@H](N)[C@H]3O[C@H]3O[C@H](CN)[C@@H](O)[C@H](O)[C@H]3N)[C@@H]2O)[C@H](N)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C23H46N6O13/c24-2-7-13(32)15(34)10(28)21(37-7)40-18-6(27)1-5(26)12(31)20(18)42-23-17(36)19(9(4-30)39-23)41-22-11(29)16(35)14(33)8(3-25)38-22/h5-23,30-36H,1-4,24-29H2/t5-,6+,7-,8+,9-,10-,11-,12+,13-,14-,15-,16-,17-,18-,19-,20-,21-,22-,23+/m1/s1
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n/an/an/a 5n/an/an/a7.50



Wayne State University



Assay Description
Binding assay of Aminoglycoside antibiotics and kanamycin A derivatives for the bacterial A site RNA.


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097094
PNG
(2-(4-Bromo-phenyl)-quinoline-4-carboxylic acid | C...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccc(Br)cc1
Show InChI InChI=1S/C16H10BrNO2/c17-11-7-5-10(6-8-11)15-9-13(16(19)20)12-3-1-2-4-14(12)18-15/h1-9H,(H,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Thermus thermophilus)
BDBM43824
PNG
(Aminoglycosides, 2 | MLS000533892 | N-[(E)-N''''-(...)
Show SMILES CC(C)CC(=O)NC(N)=Nc1nc2ccccc2s1
Show InChI InChI=1S/C13H16N4OS/c1-8(2)7-11(18)16-12(14)17-13-15-9-5-3-4-6-10(9)19-13/h3-6,8H,7H2,1-2H3,(H3,14,15,16,17,18)
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n/an/an/a 1.30E+6n/an/an/a7.50



Wayne State University



Assay Description
Binding assay of Aminoglycoside antibiotics and kanamycin A derivatives for the bacterial A site RNA.


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Thermus thermophilus)
BDBM43825
PNG
((Z)-3-(3-chloro-2-methyl-anilino)-2-[3-chloro-5-(t...)
Show SMILES COC(=O)C(C=Nc1cccc(Cl)c1C)c1ncc(cc1Cl)C(F)(F)F
Show InChI InChI=1S/C17H13Cl2F3N2O2/c1-9-12(18)4-3-5-14(9)23-8-11(16(25)26-2)15-13(19)6-10(7-24-15)17(20,21)22/h3-8,11H,1-2H3
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n/an/an/a 2.00E+6n/an/an/a7.50



Wayne State University



Assay Description
Binding assay of Aminoglycoside antibiotics and kanamycin A derivatives for the bacterial A site RNA.


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Thermus thermophilus)
BDBM43827
PNG
((E)-3-(1-benzyl-3-phenyl-pyrazol-4-yl)acrylic acid...)
Show SMILES OC(=O)\C=C\c1cn(Cc2ccccc2)nc1-c1ccccc1
Show InChI InChI=1S/C19H16N2O2/c22-18(23)12-11-17-14-21(13-15-7-3-1-4-8-15)20-19(17)16-9-5-2-6-10-16/h1-12,14H,13H2,(H,22,23)/b12-11+
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n/an/an/a 1.70E+6n/an/an/a7.50



Wayne State University



Assay Description
Binding assay of Aminoglycoside antibiotics and kanamycin A derivatives for the bacterial A site RNA.


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Thermus thermophilus)
BDBM43826
PNG
(2-[5-(diethylsulfamoyl)-1-(4-methoxyphenyl)benzimi...)
Show SMILES CCN(CC)S(=O)(=O)c1ccc2n(c(SC(C)C(N)=O)nc2c1)-c1ccc(OC)cc1
Show InChI InChI=1S/C21H26N4O4S2/c1-5-24(6-2)31(27,28)17-11-12-19-18(13-17)23-21(30-14(3)20(22)26)25(19)15-7-9-16(29-4)10-8-15/h7-14H,5-6H2,1-4H3,(H2,22,26)
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n/an/an/a 6.00E+5n/an/an/a7.50



Wayne State University



Assay Description
Binding assay of Aminoglycoside antibiotics and kanamycin A derivatives for the bacterial A site RNA.


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097083
PNG
(2-(3,4-Dichloro-phenyl)-quinoline-4-carboxylic aci...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C16H9Cl2NO2/c17-12-6-5-9(7-13(12)18)15-8-11(16(20)21)10-3-1-2-4-14(10)19-15/h1-8H,(H,20,21)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097088
PNG
(2-(4-Bromo-phenyl)-6,8-dimethyl-quinoline-4-carbox...)
Show SMILES Cc1cc(C)c2nc(cc(C(O)=O)c2c1)-c1ccc(Br)cc1
Show InChI InChI=1S/C18H14BrNO2/c1-10-7-11(2)17-14(8-10)15(18(21)22)9-16(20-17)12-3-5-13(19)6-4-12/h3-9H,1-2H3,(H,21,22)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097082
PNG
(2-(4-Bromo-phenyl)-6-iodo-quinoline-4-carboxylic a...)
Show SMILES OC(=O)c1cc(nc2ccc(I)cc12)-c1ccc(Br)cc1
Show InChI InChI=1S/C16H9BrINO2/c17-10-3-1-9(2-4-10)15-8-13(16(20)21)12-7-11(18)5-6-14(12)19-15/h1-8H,(H,20,21)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097090
PNG
(2-(4-Bromo-phenyl)-6-chloro-quinoline-4-carboxylic...)
Show SMILES OC(=O)c1cc(nc2ccc(Cl)cc12)-c1ccc(Br)cc1
Show InChI InChI=1S/C16H9BrClNO2/c17-10-3-1-9(2-4-10)15-8-13(16(20)21)12-7-11(18)5-6-14(12)19-15/h1-8H,(H,20,21)
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n/an/a>2.00E+4n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097097
PNG
(2-Pyridin-4-yl-quinoline-4-carboxylic acid | CHEMB...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccncc1
Show InChI InChI=1S/C15H10N2O2/c18-15(19)12-9-14(10-5-7-16-8-6-10)17-13-4-2-1-3-11(12)13/h1-9H,(H,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM35453
PNG
(2-(2-furanyl)-4-quinolinecarboxylic acid | 2-(2-fu...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccco1
Show InChI InChI=1S/C14H9NO3/c16-14(17)10-8-12(13-6-3-7-18-13)15-11-5-2-1-4-9(10)11/h1-8H,(H,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097100
PNG
(2-Phenyl-quinoline-4-carboxylic acid | 2-phenylqui...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccccc1
Show InChI InChI=1S/C16H11NO2/c18-16(19)13-10-15(11-6-2-1-3-7-11)17-14-9-5-4-8-12(13)14/h1-10H,(H,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Homo sapiens)
BDBM50097098
PNG
(2-(5-Chloro-thiophen-2-yl)-quinoline-4-carboxylic ...)
Show SMILES OC(=O)c1cc(nc2ccccc12)-c1ccc(Cl)s1
Show InChI InChI=1S/C14H8ClNO2S/c15-13-6-5-12(19-13)11-7-9(14(17)18)8-3-1-2-4-10(8)16-11/h1-7H,(H,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Cubist Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Aminoacylation activity against human prolyl-tRNA synthetase


Citation and Details
More data for this
Ligand-Target Pair
Aminoacyl-tRNA synthetase


(Thermus thermophilus)
BDBM43823
PNG
(Kanamycin A, 1 | MLS000531200 | N-(2,3-dihydro-1,4...)
Show SMILES O=C(Nc1ccc2OCCOc2c1)c1cccc(c1)S(=O)(=O)N1CCCCC1
Show InChI InChI=1S/C20H22N2O5S/c23-20(21-16-7-8-18-19(14-16)27-12-11-26-18)15-5-4-6-17(13-15)28(24,25)22-9-2-1-3-10-22/h4-8,13-14H,1-3,9-12H2,(H,21,23)
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n/an/an/a 1.10E+3n/an/an/a7.50



Wayne State University



Assay Description
Binding assay of Aminoglycoside antibiotics and kanamycin A derivatives for the bacterial A site RNA.


Citation and Details
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 9 hits for monomerid = 19,35453,43823,43824,43825,43826,43827,50097094,50097097,50097098,50097100,50097082,50097083,50097088,50097090
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
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PC cid
PC sid
PDB
-8.5313.2-21.76.25725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
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KEGG
MMDB
PC cid
PC sid
PDB
-7.8511.7-19.45.76725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
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KEGG
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PC cid
PC sid
PDB
-6.836.58-13.45.01725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
-6.224.77-11.04.56725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
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KEGG
MMDB
PC cid
PC sid
PDB
-5.523.59-9.034.17725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
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KEGG
MMDB
PC cid
PC sid
PDB
-4.820-4.823.53725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
-6.6212.9-19.54.89725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
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KEGG
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PC cid
PC sid
PDB
-6.396.91-17.34.69725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)

RNA(23-mer)

(NULL)
BDBM19
JPEG
((2S,3S,4R,5R,6R)-5-amino-2-(aminomethyl)-6-{[(2R,3...)
GoogleScholar
CHEBI
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
-5.965.68-11.74.37725



The Ohio State University





Nucleic Acids Res 28: 2935-42 (2000)