BindingDB logo
myBDB logout

PubMed code 24032981

Compile data set for download or QSAR
Found 25 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
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441210
PNG
(CHEMBL2431008)
Show SMILES CN(O)C(=O)CSC(c1ccc(Cl)c(Cl)c1)P(O)(O)=O
Show InChI InChI=1S/C10H12Cl2NO5PS/c1-13(15)9(14)5-20-10(19(16,17)18)6-2-3-7(11)8(12)4-6/h2-4,10,15H,5H2,1H3,(H2,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 9.20n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441211
PNG
(CHEMBL2431007)
Show SMILES CN(O)C(=O)CSC(c1ccc(F)c(F)c1)P(O)(O)=O
Show InChI InChI=1S/C10H12F2NO5PS/c1-13(15)9(14)5-20-10(19(16,17)18)6-2-3-7(11)8(12)4-6/h2-4,10,15H,5H2,1H3,(H2,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 42n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441208
PNG
(CHEMBL2431010)
Show SMILES CN(O)C(=O)CSC(c1ccc(C)cc1)P(O)(O)=O
Show InChI InChI=1S/C11H16NO5PS/c1-8-3-5-9(6-4-8)11(18(15,16)17)19-7-10(13)12(2)14/h3-6,11,14H,7H2,1-2H3,(H2,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 110n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441189
PNG
(CHEMBL2431003)
Show SMILES CN(O)C(=O)CS[C@@H](c1ccccc1)P(O)(O)=O |r|
Show InChI InChI=1S/C10H14NO5PS/c1-11(13)9(12)7-18-10(17(14,15)16)8-5-3-2-4-6-8/h2-6,10,13H,7H2,1H3,(H2,14,15,16)/t10-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars
Article
PubMed
n/an/a 120n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50153713
PNG
(3-(N-hydroxyformamido)propylphosphonic acid | 3-[F...)
Show SMILES ON(CCCP(O)(O)=O)C=O
Show InChI InChI=1S/C4H10NO5P/c6-4-5(7)2-1-3-11(8,9)10/h4,7H,1-3H2,(H2,8,9,10)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
DrugBank
MMDB
PC cid
PC sid
PDB
UniChem

Patents

Similars
PDB
Article
PubMed
n/an/a 230n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441195
PNG
(CHEMBL1830119)
Show SMILES CN(O)C(=O)CCC(c1ccc(Cl)c(Cl)c1)P(O)(O)=O
Show InChI InChI=1S/C11H14Cl2NO5P/c1-14(16)11(15)5-4-10(20(17,18)19)7-2-3-8(12)9(13)6-7/h2-3,6,10,16H,4-5H2,1H3,(H2,17,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 280n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441189
PNG
(CHEMBL2431003)
Show SMILES CN(O)C(=O)CS[C@@H](c1ccccc1)P(O)(O)=O |r|
Show InChI InChI=1S/C10H14NO5PS/c1-11(13)9(12)7-18-10(17(14,15)16)8-5-3-2-4-6-8/h2-6,10,13H,7H2,1H3,(H2,14,15,16)/t10-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
MMDB
PC cid
PC sid
PDB
UniChem

Similars
Article
PubMed
n/an/a 280n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441209
PNG
(CHEMBL2431009)
Show SMILES CN(O)C(=O)CSC(c1cccc2ccccc12)P(O)(O)=O
Show InChI InChI=1S/C14H16NO5PS/c1-15(17)13(16)9-22-14(21(18,19)20)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,14,17H,9H2,1H3,(H2,18,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 550n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441205
PNG
(CHEMBL2431013)
Show SMILES ONC(=O)CSC(c1ccc(Cl)c(Cl)c1)P(O)(O)=O
Show InChI InChI=1S/C9H10Cl2NO5PS/c10-6-2-1-5(3-7(6)11)9(18(15,16)17)19-4-8(13)12-14/h1-3,9,14H,4H2,(H,12,13)(H2,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 720n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441196
PNG
(CHEMBL1830118)
Show SMILES CN(O)C(=O)CCC(c1ccc(F)c(F)c1)P(O)(O)=O
Show InChI InChI=1S/C11H14F2NO5P/c1-14(16)11(15)5-4-10(20(17,18)19)7-2-3-8(12)9(13)6-7/h2-3,6,10,16H,4-5H2,1H3,(H2,17,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Similars
Article
PubMed
n/an/a 770n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441202
PNG
(CHEMBL2164263)
Show SMILES CN(O)C(=O)COC(c1ccc(Cl)c(Cl)c1)P(O)(O)=O
Show InChI InChI=1S/C10H12Cl2NO6P/c1-13(15)9(14)5-19-10(20(16,17)18)6-2-3-7(11)8(12)4-6/h2-4,10,15H,5H2,1H3,(H2,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441206
PNG
(CHEMBL2431012)
Show SMILES ONC(=O)CSC(c1ccc(F)c(F)c1)P(O)(O)=O
Show InChI InChI=1S/C9H10F2NO5PS/c10-6-2-1-5(3-7(6)11)9(18(15,16)17)19-4-8(13)12-14/h1-3,9,14H,4H2,(H,12,13)(H2,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441193
PNG
(CHEMBL2164256)
Show SMILES CN(O)C(=O)CCC(c1ccc(C)cc1)P(O)(O)=O
Show InChI InChI=1S/C12H18NO5P/c1-9-3-5-10(6-4-9)11(19(16,17)18)7-8-12(14)13(2)15/h3-6,11,15H,7-8H2,1-2H3,(H2,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
PDB
UniChem

Similars
Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441197
PNG
(CHEMBL2164255)
Show SMILES CN(O)C(=O)CCC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C11H16NO5P/c1-12(14)11(13)8-7-10(18(15,16)17)9-5-3-2-4-6-9/h2-6,10,14H,7-8H2,1H3,(H2,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 2.00E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441191
PNG
(CHEMBL1830114)
Show SMILES ONC(=O)CCC(c1ccc(F)c(F)c1)P(O)(O)=O
Show InChI InChI=1S/C10H12F2NO5P/c11-7-2-1-6(5-8(7)12)9(19(16,17)18)3-4-10(14)13-15/h1-2,5,9,15H,3-4H2,(H,13,14)(H2,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 3.40E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441200
PNG
(CHEMBL2164264)
Show SMILES CN(O)C(=O)COC(c1ccc(C)cc1)P(O)(O)=O
Show InChI InChI=1S/C11H16NO6P/c1-8-3-5-9(6-4-8)11(19(15,16)17)18-7-10(13)12(2)14/h3-6,11,14H,7H2,1-2H3,(H2,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.00E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441203
PNG
(CHEMBL2164262)
Show SMILES CN(O)C(=O)COC(c1ccc(F)c(F)c1)P(O)(O)=O
Show InChI InChI=1S/C10H12F2NO6P/c1-13(15)9(14)5-19-10(20(16,17)18)6-2-3-7(11)8(12)4-6/h2-4,10,15H,5H2,1H3,(H2,16,17,18)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.60E+3n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441194
PNG
(CHEMBL1830117)
Show SMILES CN(O)C(=O)CCC(c1cccc2ccccc12)P(O)(O)=O
Show InChI InChI=1S/C15H18NO5P/c1-16(18)15(17)10-9-14(22(19,20)21)13-8-4-6-11-5-2-3-7-12(11)13/h2-8,14,18H,9-10H2,1H3,(H2,19,20,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.30E+4n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441192
PNG
(CHEMBL2431005)
Show SMILES ONC(=O)CCC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C10H14NO5P/c12-10(11-13)7-6-9(17(14,15)16)8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H,11,12)(H2,14,15,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.40E+4n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441207
PNG
(CHEMBL2431011)
Show SMILES ONC(=O)CSC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C9H12NO5PS/c11-8(10-12)6-17-9(16(13,14)15)7-4-2-1-3-5-7/h1-5,9,12H,6H2,(H,10,11)(H2,13,14,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441201
PNG
(CHEMBL2164259)
Show SMILES CN(O)C(=O)COC(c1cccc2ccccc12)P(O)(O)=O
Show InChI InChI=1S/C14H16NO6P/c1-15(17)13(16)9-21-14(22(18,19)20)12-8-4-6-10-5-2-3-7-11(10)12/h2-8,14,17H,9H2,1H3,(H2,18,19,20)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441204
PNG
(CHEMBL2164258)
Show SMILES CN(O)C(=O)COC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C10H14NO6P/c1-11(13)9(12)7-17-10(18(14,15)16)8-5-3-2-4-6-8/h2-6,10,13H,7H2,1H3,(H2,14,15,16)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 1.60E+4n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441190
PNG
(CHEMBL2431004)
Show SMILES CN(O)C(=O)CS[C@H](c1ccccc1)P(O)(O)=O |r|
Show InChI InChI=1S/C10H14NO5PS/c1-11(13)9(12)7-18-10(17(14,15)16)8-5-3-2-4-6-8/h2-6,10,13H,7H2,1H3,(H2,14,15,16)/t10-/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 8.30E+4n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441199
PNG
(CHEMBL2164266)
Show SMILES ONC(=O)COC(c1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C9H12NO6P/c11-8(10-12)6-16-9(17(13,14)15)7-4-2-1-3-5-7/h1-5,9,12H,6H2,(H,10,11)(H2,13,14,15)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 4.66E+5n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
1-deoxy-D-xylulose 5-phosphate reductoisomerase


(Mycobacterium tuberculosis)		BDBM50441198
PNG
(CHEMBL2431014)
Show SMILES ONC(=O)COC(c1ccc(F)c(F)c1)P(O)(O)=O
Show InChI InChI=1S/C9H10F2NO6P/c10-6-2-1-5(3-7(6)11)9(19(15,16)17)18-4-8(13)12-14/h1-3,9,14H,4H2,(H,12,13)(H2,15,16,17)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>5.00E+5n/an/an/an/an/an/a



Lehrstuhl für Biochemie

Curated by ChEMBL


Assay Description
Inhibition of Mycobacterium tuberculosis IspC by photometric assay

J Med Chem 56: 8151-62 (2013)


Article DOI: 10.1021/jm4012559
BindingDB Entry DOI: 10.7270/Q2JH3NN8
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%