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12 similar compounds to monomer 50123355

Compile data set for download or QSAR
Wt: 429.4
BDBM50123345
Wt: 459.4
BDBM50123348
Wt: 514.5
BDBM50123351
Wt: 413.4
BDBM50123353
Wt: 443.4
BDBM50123356
Wt: 401.4
BDBM50123359
Wt: 416.4
BDBM50123360
Wt: 427.4
BDBM50123361
Wt: 373.4
BDBM50123367
Wt: 415.4
BDBM50123368
Wt: 431.4
BDBM50123373
Wt: 387.4
BDBM50123376

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 12 hits for monomerid = 50123345,50123348,50123351,50123353,50123356,50123359,50123360,50123361,50123367,50123368,50123373,50123376   
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))
BDBM50123348
PNG
(2-Methoxy-N-[6-(7-methoxy-6-oxazol-5-yl-4-oxo-1,4-...)
Show SMILES COCC(=O)N(C)C1CCc2ccc(cc12)-c1cc(O)c2cc(-c3cnco3)c(OC)cc2n1
Show InChI InChI=1S/C26H25N3O5/c1-29(26(31)13-32-2)22-7-6-15-4-5-16(8-17(15)22)20-10-23(30)18-9-19(25-12-27-14-34-25)24(33-3)11-21(18)28-20/h4-5,8-12,14,22H,6-7,13H2,1-3H3,(H,28,30)
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n/an/a 12n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123345
PNG
(CHEMBL153516 | N-[6-(7-Methoxy-6-oxazol-5-yl-4-oxo...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N(C)C(C)=O)c2c1
Show InChI InChI=1S/C25H23N3O4/c1-14(29)28(2)22-7-6-15-4-5-16(8-17(15)22)20-10-23(30)18-9-19(25-12-26-13-32-25)24(31-3)11-21(18)27-20/h4-5,8-13,22H,6-7H2,1-3H3,(H,27,30)
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n/an/a 18n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123351
PNG
(CHEMBL154867 | N-[6-(7-Methoxy-6-oxazol-5-yl-4-oxo...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N(C)C(=O)CN3CCOCC3)c2c1
Show InChI InChI=1S/C29H30N4O5/c1-32(29(35)16-33-7-9-37-10-8-33)25-6-5-18-3-4-19(11-20(18)25)23-13-26(34)21-12-22(28-15-30-17-38-28)27(36-2)14-24(21)31-23/h3-4,11-15,17,25H,5-10,16H2,1-2H3,(H,31,34)
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n/an/a 18n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123353
PNG
(2-(3-Azetidin-1-yl-indan-5-yl)-7-methoxy-6-oxazol-...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N3CCC3)c2c1
Show InChI InChI=1S/C25H23N3O3/c1-30-24-12-21-18(10-19(24)25-13-26-14-31-25)23(29)11-20(27-21)16-4-3-15-5-6-22(17(15)9-16)28-7-2-8-28/h3-4,9-14,22H,2,5-8H2,1H3,(H,27,29)
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n/an/a 6n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123356
PNG
(7-Methoxy-2-(3-morpholin-4-yl-indan-5-yl)-6-oxazol...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N3CCOCC3)c2c1
Show InChI InChI=1S/C26H25N3O4/c1-31-25-13-22-19(11-20(25)26-14-27-15-33-26)24(30)12-21(28-22)17-3-2-16-4-5-23(18(16)10-17)29-6-8-32-9-7-29/h2-3,10-15,23H,4-9H2,1H3,(H,28,30)
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n/an/a 20n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123361
PNG
(7-Methoxy-6-oxazol-5-yl-2-(3-pyrrolidin-1-yl-indan...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N3CCCC3)c2c1
Show InChI InChI=1S/C26H25N3O3/c1-31-25-13-22-19(11-20(25)26-14-27-15-32-26)24(30)12-21(28-22)17-5-4-16-6-7-23(18(16)10-17)29-8-2-3-9-29/h4-5,10-15,23H,2-3,6-9H2,1H3,(H,28,30)
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n/an/a 13n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123368
PNG
(2-(8-Dimethylamino-5,6,7,8-tetrahydro-naphthalen-2...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCCC(N(C)C)c2c1
Show InChI InChI=1S/C25H25N3O3/c1-28(2)22-6-4-5-15-7-8-16(9-17(15)22)20-11-23(29)18-10-19(25-13-26-14-31-25)24(30-3)12-21(18)27-20/h7-14,22H,4-6H2,1-3H3,(H,27,29)
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n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123359
PNG
(2-(1-Dimethylamino-indan-5-yl)-7-methoxy-6-oxazol-...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2C(CCc2c1)N(C)C
Show InChI InChI=1S/C24H23N3O3/c1-27(2)21-7-5-14-8-15(4-6-16(14)21)19-10-22(28)17-9-18(24-12-25-13-30-24)23(29-3)11-20(17)26-19/h4,6,8-13,21H,5,7H2,1-3H3,(H,26,28)
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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 against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123376
PNG
(7-Methoxy-2-(3-methylamino-indan-5-yl)-6-oxazol-5-...)
Show SMILES CNC1CCc2ccc(cc12)-c1cc(O)c2cc(-c3cnco3)c(OC)cc2n1
Show InChI InChI=1S/C23H21N3O3/c1-24-18-6-5-13-3-4-14(7-15(13)18)19-9-21(27)16-8-17(23-11-25-12-29-23)22(28-2)10-20(16)26-19/h3-4,7-12,18,24H,5-6H2,1-2H3,(H,26,27)
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n/an/a 12n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123360
PNG
(CHEMBL155616 | [6-(7-Methoxy-6-oxazol-5-yl-4-oxo-1...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(c2c1)[N+](C)(C)C
Show InChI InChI=1S/C25H25N3O3/c1-28(2,3)22-8-7-15-5-6-16(9-17(15)22)20-11-23(29)18-10-19(25-13-26-14-31-25)24(30-4)12-21(18)27-20/h5-6,9-14,22H,7-8H2,1-4H3/p+1
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n/an/a 30n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123373
PNG
(2-((2R,3R)-3-Dimethylamino-2-methoxy-indan-5-yl)-7...)
Show SMILES CO[C@@H]1Cc2ccc(cc2[C@H]1N(C)C)-c1cc(O)c2cc(-c3cnco3)c(OC)cc2n1
Show InChI InChI=1S/C25H25N3O4/c1-28(2)25-16-7-15(6-5-14(16)8-23(25)31-4)19-10-21(29)17-9-18(24-12-26-13-32-24)22(30-3)11-20(17)27-19/h5-7,9-13,23,25H,8H2,1-4H3,(H,27,29)/t23-,25-/m1/s1
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n/an/a 15n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair
Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)


(Homo sapiens (Human))
BDBM50123367
PNG
(7-Methoxy-2-(2-methyl-2,3-dihydro-1H-isoindol-5-yl...)
Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CN(C)Cc2c1
Show InChI InChI=1S/C22H19N3O3/c1-25-10-14-4-3-13(5-15(14)11-25)18-7-20(26)16-6-17(22-9-23-12-28-22)21(27-2)8-19(16)24-18/h3-9,12H,10-11H2,1-2H3,(H,24,26)
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n/an/a 14n/an/an/an/an/an/a



Bristol-Myers Squibb PRI

Curated by ChEMBL


Assay Description
Inhibitory activity against inosine monophosphate dehydrogenase IMPDH II


Bioorg Med Chem Lett 13: 547-51 (2003)


Article DOI: 10.1016/s0960-894x(02)00945-9
BindingDB Entry DOI: 10.7270/Q2NS0T7H
More data for this
Ligand-Target Pair