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3 similar compounds to monomer 50126012

Compile data set for download or QSAR
Wt: 324.3
BDBM50123320
Wt: 374.4
BDBM50126005
Wt: 371.4
BDBM50126006

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50123320,50126005,50126006   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50126005
PNG
(2-Benzo[b]thiophen-3-yl-6-methoxy-5-oxazol-5-yl-1H...)
Show SMILES COc1cc2[nH]c(c(C=O)c2cc1-c1cnco1)-c1csc2ccccc12
Show InChI InChI=1S/C21H14N2O3S/c1-25-18-7-17-13(6-14(18)19-8-22-11-26-19)15(9-24)21(23-17)16-10-27-20-5-3-2-4-12(16)20/h2-11,23H,1H3
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n/an/a 30n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibition of 5'-inosine monophosphate dehydrogenase type II (IMPDH II)


Bioorg Med Chem Lett 13: 1273-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00109-4
BindingDB Entry DOI: 10.7270/Q2T1530J
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50126006
PNG
(2-Benzo[b]thiophen-3-yl-6-methoxy-5-oxazol-5-yl-1H...)
Show SMILES COc1cc2[nH]c(-c3csc4ccccc34)c(C#N)c2cc1-c1cnco1
Show InChI InChI=1S/C21H13N3O2S/c1-25-18-7-17-13(6-14(18)19-9-23-11-26-19)15(8-22)21(24-17)16-10-27-20-5-3-2-4-12(16)20/h2-7,9-11,24H,1H3
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Article
PubMed
n/an/a 64n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibition of 5'-inosine monophosphate dehydrogenase type II (IMPDH II)


Bioorg Med Chem Lett 13: 1273-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00109-4
BindingDB Entry DOI: 10.7270/Q2T1530J
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 1 (IMPDH1)


(Homo sapiens (Human))
BDBM50123320
PNG
(7-Methoxy-6-oxazol-5-yl-2-thiophen-3-yl-1H-quinoli...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccsc1
Show InChI InChI=1S/C17H12N2O3S/c1-21-16-6-14-11(4-12(16)17-7-18-9-22-17)15(20)5-13(19-14)10-2-3-23-8-10/h2-9H,1H3,(H,19,20)
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n/an/a 55n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity of the compound against inosine monophosphate dehydrogenase IMPDH type I


Bioorg Med Chem Lett 13: 543-6 (2003)


Article DOI: 10.1016/s0960-894x(02)00944-7
BindingDB Entry DOI: 10.7270/Q2SJ1JZT
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123320
PNG
(7-Methoxy-6-oxazol-5-yl-2-thiophen-3-yl-1H-quinoli...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccsc1
Show InChI InChI=1S/C17H12N2O3S/c1-21-16-6-14-11(4-12(16)17-7-18-9-22-17)15(20)5-13(19-14)10-2-3-23-8-10/h2-9H,1H3,(H,19,20)
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n/an/a 9n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibition of human inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 543-6 (2003)


Article DOI: 10.1016/s0960-894x(02)00944-7
BindingDB Entry DOI: 10.7270/Q2SJ1JZT
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 1 (IMPDH1)


(Homo sapiens (Human))
BDBM50126005
PNG
(2-Benzo[b]thiophen-3-yl-6-methoxy-5-oxazol-5-yl-1H...)
Show SMILES COc1cc2[nH]c(c(C=O)c2cc1-c1cnco1)-c1csc2ccccc12
Show InChI InChI=1S/C21H14N2O3S/c1-25-18-7-17-13(6-14(18)19-8-22-11-26-19)15(9-24)21(23-17)16-10-27-20-5-3-2-4-12(16)20/h2-11,23H,1H3
PDB
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Article
PubMed
n/an/a 160n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibition of 5'-inosine monophosphate dehydrogenase type I (IMPDH I)


Bioorg Med Chem Lett 13: 1273-6 (2003)


Article DOI: 10.1016/s0960-894x(03)00109-4
BindingDB Entry DOI: 10.7270/Q2T1530J
More data for this
Ligand-Target Pair