Found 36 hits of Enzyme Inhibition Constant Data Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123358
(7-Methoxy-2-(4-methyl-3-morpholin-4-yl-phenyl)-6-o...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(C)c(c1)N1CCOCC1 Show InChI InChI=1S/C24H23N3O4/c1-15-3-4-16(9-21(15)27-5-7-30-8-6-27)19-11-22(28)17-10-18(24-13-25-14-31-24)23(29-2)12-20(17)26-19/h3-4,9-14H,5-8H2,1-2H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50222633
(CHEMBL356881)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(C)c(OCC2CCCO2)c1 Show InChI InChI=1S/C25H24N2O5/c1-15-5-6-16(8-23(15)31-13-17-4-3-7-30-17)20-10-22(28)18-9-19(25-12-26-14-32-25)24(29-2)11-21(18)27-20/h5-6,8-12,14,17H,3-4,7,13H2,1-2H3,(H,27,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | <5 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123355
(2-(3-Dimethylamino-indan-5-yl)-7-methoxy-6-oxazol-...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N(C)C)c2c1 Show InChI InChI=1S/C24H23N3O3/c1-27(2)21-7-6-14-4-5-15(8-16(14)21)19-10-22(28)17-9-18(24-12-25-13-30-24)23(29-3)11-20(17)26-19/h4-5,8-13,21H,6-7H2,1-3H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | <5 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50222630
(CHEMBL153481)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(C)c(OCCN2CCOCC2)c1 Show InChI InChI=1S/C26H27N3O5/c1-17-3-4-18(11-24(17)33-10-7-29-5-8-32-9-6-29)21-13-23(30)19-12-20(26-15-27-16-34-26)25(31-2)14-22(19)28-21/h3-4,11-16H,5-10H2,1-2H3,(H,28,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | <5 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123355
(2-(3-Dimethylamino-indan-5-yl)-7-methoxy-6-oxazol-...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N(C)C)c2c1 Show InChI InChI=1S/C24H23N3O3/c1-27(2)21-7-6-14-4-5-15(8-16(14)21)19-10-22(28)17-9-18(24-12-25-13-30-24)23(29-3)11-20(17)26-19/h4-5,8-13,21H,6-7H2,1-3H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | <5 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123353
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123355
(2-(3-Dimethylamino-indan-5-yl)-7-methoxy-6-oxazol-...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N(C)C)c2c1 Show InChI InChI=1S/C24H23N3O3/c1-27(2)21-7-6-14-4-5-15(8-16(14)21)19-10-22(28)17-9-18(24-12-25-13-30-24)23(29-3)11-20(17)26-19/h4-5,8-13,21H,6-7H2,1-3H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50102249
((S)-tetrahydrofuran-3-yl 3-(3-(3-methoxy-4-(oxazol...)Show SMILES COc1cc(NC(=O)Nc2cccc(CNC(=O)O[C@H]3CCOC3)c2)ccc1-c1cnco1 Show InChI InChI=1S/C23H24N4O6/c1-30-20-10-17(5-6-19(20)21-12-24-14-32-21)27-22(28)26-16-4-2-3-15(9-16)11-25-23(29)33-18-7-8-31-13-18/h2-6,9-10,12,14,18H,7-8,11,13H2,1H3,(H,25,29)(H2,26,27,28)/t18-/m0/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50222632
(CHEMBL356236)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCCC(=O)c2c1 Show InChI InChI=1S/C23H18N2O4/c1-28-22-10-19-16(8-17(22)23-11-24-12-29-23)21(27)9-18(25-19)14-6-5-13-3-2-4-20(26)15(13)7-14/h5-12H,2-4H2,1H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | <10 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123350
(CHEMBL423952 | Dimethyl-carbamic acid 6-(7-methoxy...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(OC(=O)N(C)C)c2c1 Show InChI InChI=1S/C25H23N3O5/c1-28(2)25(30)33-22-7-6-14-4-5-15(8-16(14)22)19-10-21(29)17-9-18(24-12-26-13-32-24)23(31-3)11-20(17)27-19/h4-5,8-13,22H,6-7H2,1-3H3,(H,27,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123348
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123376
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123361
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123370
(2-(4-Acetyl-3,4-dihydro-2H-benzo[1,4]oxazin-6-yl)-...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2OCCN(C(C)=O)c2c1 Show InChI InChI=1S/C23H19N3O5/c1-13(27)26-5-6-30-21-4-3-14(7-19(21)26)17-9-20(28)15-8-16(23-11-24-12-31-23)22(29-2)10-18(15)25-17/h3-4,7-12H,5-6H2,1-2H3,(H,25,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM19264
((4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dih...)Show InChI InChI=1S/C17H20O6/c1-9(5-7-13(18)19)4-6-11-15(20)14-12(8-23-17(14)21)10(2)16(11)22-3/h4,20H,5-8H2,1-3H3,(H,18,19)/b9-4+ | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
DrugBank
MCE
MMDB
PC cid
PC sid
PDB
UniChem
Patents
Similars
| DrugBank
PDB
PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123367
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123373
(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 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123375
(7-Methoxy-2-(4-methyl-3-pyrrolidin-1-yl-phenyl)-6-...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(C)c(c1)N1CCCC1 Show InChI InChI=1S/C24H23N3O3/c1-15-5-6-16(9-21(15)27-7-3-4-8-27)19-11-22(28)17-10-18(24-13-25-14-30-24)23(29-2)12-20(17)26-19/h5-6,9-14H,3-4,7-8H2,1-2H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123368
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123371
(7-Methoxy-2-[3-(4-methyl-piperazin-1-yl)-phenyl]-6...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1cccc(c1)N1CCN(C)CC1 Show InChI InChI=1S/C24H24N4O3/c1-27-6-8-28(9-7-27)17-5-3-4-16(10-17)20-12-22(29)18-11-19(24-14-25-15-31-24)23(30-2)13-21(18)26-20/h3-5,10-15H,6-9H2,1-2H3,(H,26,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123345
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123351
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123356
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123366
(2-(4-Dimethylamino-chroman-6-yl)-7-methoxy-6-oxazo...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2OCCC(N(C)C)c2c1 Show InChI InChI=1S/C24H23N3O4/c1-27(2)20-6-7-30-22-5-4-14(8-16(20)22)18-10-21(28)15-9-17(24-12-25-13-31-24)23(29-3)11-19(15)26-18/h4-5,8-13,20H,6-7H2,1-3H3,(H,26,28) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123363
(7-Methoxy-2-(4-morpholin-4-yl-phenyl)-6-oxazol-5-y...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(cc1)N1CCOCC1 Show InChI InChI=1S/C23H21N3O4/c1-28-22-12-20-17(10-18(22)23-13-24-14-30-23)21(27)11-19(25-20)15-2-4-16(5-3-15)26-6-8-29-9-7-26/h2-5,10-14H,6-9H2,1H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 21 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123354
(7-Methoxy-6-oxazol-5-yl-2-(3-pyrrolidin-1-yl-pheny...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1cccc(c1)N1CCCC1 Show InChI InChI=1S/C23H21N3O3/c1-28-22-12-20-17(10-18(22)23-13-24-14-29-23)21(27)11-19(25-20)15-5-4-6-16(9-15)26-7-2-3-8-26/h4-6,9-14H,2-3,7-8H2,1H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 25 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123362
(7-Methoxy-2-[4-methyl-3-(4-methyl-piperazin-1-yl)-...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(C)c(c1)N1CCN(C)CC1 Show InChI InChI=1S/C25H26N4O3/c1-16-4-5-17(10-22(16)29-8-6-28(2)7-9-29)20-12-23(30)18-11-19(25-14-26-15-32-25)24(31-3)13-21(18)27-20/h4-5,10-15H,6-9H2,1-3H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 26 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123346
(2-(3-Hydroxy-indan-5-yl)-7-methoxy-6-oxazol-5-yl-1...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(O)c2c1 Show InChI InChI=1S/C22H18N2O4/c1-27-21-9-18-15(7-16(21)22-10-23-11-28-22)20(26)8-17(24-18)13-3-2-12-4-5-19(25)14(12)6-13/h2-3,6-11,19,25H,4-5H2,1H3,(H,24,26) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 28 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123360
(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 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 30 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123365
(7-Methoxy-6-oxazol-5-yl-2-(4-pyrrolidin-1-yl-chrom...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2OCCC(N3CCCC3)c2c1 Show InChI InChI=1S/C26H25N3O4/c1-31-25-13-21-17(11-19(25)26-14-27-15-33-26)23(30)12-20(28-21)16-4-5-24-18(10-16)22(6-9-32-24)29-7-2-3-8-29/h4-5,10-15,22H,2-3,6-9H2,1H3,(H,28,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 33 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50222631
(CHEMBL151060)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1cccc(c1)N1CCOCC1 Show InChI InChI=1S/C23H21N3O4/c1-28-22-12-20-17(10-18(22)23-13-24-14-30-23)21(27)11-19(25-20)15-3-2-4-16(9-15)26-5-7-29-8-6-26/h2-4,9-14H,5-8H2,1H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | <50 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123349
(7-Methoxy-2-[4-(4-methyl-piperazin-1-yl)-phenyl]-6...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc(cc1)N1CCN(C)CC1 Show InChI InChI=1S/C24H24N4O3/c1-27-7-9-28(10-8-27)17-5-3-16(4-6-17)20-12-22(29)18-11-19(24-14-25-15-31-24)23(30-2)13-21(18)26-20/h3-6,11-15H,7-10H2,1-2H3,(H,26,29) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 53 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123359
(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) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 55 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123374
(2-Imidazol-1-yl-N-[6-(7-methoxy-6-oxazol-5-yl-4-ox...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCC(N(C)C(=O)Cn3ccnc3)c2c1 Show InChI InChI=1S/C28H25N5O4/c1-32(28(35)14-33-8-7-29-15-33)24-6-5-17-3-4-18(9-19(17)24)22-11-25(34)20-10-21(27-13-30-16-37-27)26(36-2)12-23(20)31-22/h3-4,7-13,15-16,24H,5-6,14H2,1-2H3,(H,31,34) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| PubMed
| n/a | n/a | 68 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123352
(2-(8-Hydroxy-5,6,7,8-tetrahydro-naphthalen-2-yl)-7...)Show SMILES COc1cc2nc(cc(O)c2cc1-c1cnco1)-c1ccc2CCCC(O)c2c1 Show InChI InChI=1S/C23H20N2O4/c1-28-22-10-19-16(8-17(22)23-11-24-12-29-23)21(27)9-18(25-19)14-6-5-13-3-2-4-20(26)15(13)7-14/h5-12,20,26H,2-4H2,1H3,(H,25,27) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 83 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
Inosine-5'-monophosphate dehydrogenase 2
(Homo sapiens (Human)) | BDBM50123369
(7-Methoxy-2-[4-methoxy-3-(4-methyl-piperazin-1-yl)...)Show SMILES COc1ccc(cc1N1CCN(C)CC1)-c1cc(O)c2cc(-c3cnco3)c(OC)cc2n1 Show InChI InChI=1S/C25H26N4O4/c1-28-6-8-29(9-7-28)21-10-16(4-5-23(21)31-2)19-12-22(30)17-11-18(25-14-26-15-33-25)24(32-3)13-20(17)27-19/h4-5,10-15H,6-9H2,1-3H3,(H,27,30) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| PubMed
| n/a | n/a | 140 | n/a | n/a | n/a | n/a | n/a | n/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)
BindingDB Entry DOI: 10.7270/Q2NS0T7H |
More data for this
Ligand-Target Pair | |
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