Compile Data Set for Download or QSAR

Found 30 hits of ic50 for UniProtKB: P20839   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50112565 (CHEMBL25138 | N-tert-Butyl-N'-(3-methoxy-4-oxazol-...) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1cnco1 Show InChI InChI=1S/C16H19N3O4/c1-16(2,3)19-15(21)14(20)18-10-5-6-11(12(7-10)22-4)13-8-17-9-23-13/h5-9H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50112568 (CHEMBL24092 | N-tert-Butyl-N'-(3-chloro-4-oxazol-5...) Show SMILES CC(C)(C)NC(=O)C(=O)Nc1ccc(-c2cnco2)c(Cl)c1 Show InChI InChI=1S/C15H16ClN3O3/c1-15(2,3)19-14(21)13(20)18-9-4-5-10(11(16)6-9)12-7-17-8-22-12/h4-8H,1-3H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220617 (CHEMBL47928) Show SMILES Cc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1cnco1 Show InChI InChI=1S/C16H19N3O3/c1-10-7-11(5-6-12(10)13-8-17-9-22-13)18-14(20)15(21)19-16(2,3)4/h5-9H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220681 (CHEMBL45658) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1ocnc1C Show InChI InChI=1S/C17H21N3O4/c1-10-14(24-9-18-10)12-7-6-11(8-13(12)23-5)19-15(21)16(22)20-17(2,3)4/h6-9H,1-5H3,(H,19,21)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220682 (CHEMBL46358) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1cocn1 Show InChI InChI=1S/C16H19N3O4/c1-16(2,3)19-15(21)14(20)18-10-5-6-11(13(7-10)22-4)12-8-23-9-17-12/h5-9H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	470	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220679 (CHEMBL45504) Show SMILES CC(C)(C)NC(=O)C(=O)Nc1ccc(-c2cnco2)c(F)c1 Show InChI InChI=1S/C15H16FN3O3/c1-15(2,3)19-14(21)13(20)18-9-4-5-10(11(16)6-9)12-7-17-8-22-12/h4-8H,1-3H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	730	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220673 (CHEMBL48668) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1cncs1 Show InChI InChI=1S/C16H19N3O3S/c1-16(2,3)19-15(21)14(20)18-10-5-6-11(12(7-10)22-4)13-8-17-9-23-13/h5-9H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	910	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220616 (CHEMBL47830) Show SMILES CCc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1cnco1 Show InChI InChI=1S/C17H21N3O3/c1-5-11-8-12(6-7-13(11)14-9-18-10-23-14)19-15(21)16(22)20-17(2,3)4/h6-10H,5H2,1-4H3,(H,19,21)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220671 (CHEMBL44696) Show SMILES CCOc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1cnco1 Show InChI InChI=1S/C17H21N3O4/c1-5-23-13-8-11(6-7-12(13)14-9-18-10-24-14)19-15(21)16(22)20-17(2,3)4/h6-10H,5H2,1-4H3,(H,19,21)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220672 (CHEMBL416079) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1ccc[nH]1 Show InChI InChI=1S/C17H21N3O3/c1-17(2,3)20-16(22)15(21)19-11-7-8-12(14(10-11)23-4)13-6-5-9-18-13/h5-10,18H,1-4H3,(H,19,21)(H,20,22)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220615 (CHEMBL47067) Show SMILES CC(C)(C)NC(=O)C(=O)Nc1ccc(-c2cnco2)c(O)c1 Show InChI InChI=1S/C15H17N3O4/c1-15(2,3)18-14(21)13(20)17-9-4-5-10(11(19)6-9)12-7-16-8-22-12/h4-8,19H,1-3H3,(H,17,20)(H,18,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220618 (CHEMBL45771) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1ccco1 Show InChI InChI=1S/C17H20N2O4/c1-17(2,3)19-16(21)15(20)18-11-7-8-12(14(10-11)22-4)13-6-5-9-23-13/h5-10H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	8.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50112570 (CHEMBL279957 | N-tert-Butyl-N'-[4-(4-methyl-oxazol...) Show SMILES Cc1ncoc1-c1ccc(NC(=O)C(=O)NC(C)(C)C)cc1 Show InChI InChI=1S/C16H19N3O3/c1-10-13(22-9-17-10)11-5-7-12(8-6-11)18-14(20)15(21)19-16(2,3)4/h5-9H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220683 (CHEMBL432699) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1nc[nH]n1 Show InChI InChI=1S/C15H19N5O3/c1-15(2,3)19-14(22)13(21)18-9-5-6-10(11(7-9)23-4)12-16-8-17-20-12/h5-8H,1-4H3,(H,18,21)(H,19,22)(H,16,17,20)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220620 (CHEMBL297980) Show SMILES COc1ccc(NC(=O)C(=O)NC(C)(C)C)cc1-c1cnco1 Show InChI InChI=1S/C16H19N3O4/c1-16(2,3)19-15(21)14(20)18-10-5-6-12(22-4)11(7-10)13-8-17-9-23-13/h5-9H,1-4H3,(H,18,20)(H,19,21)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL MMDB PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	1.60E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220675 (CHEMBL47362) Show SMILES CC(C)(C)NC(=O)C(=O)Nc1ccc(-c2cnco2)c(c1)C(F)(F)F Show InChI InChI=1S/C16H16F3N3O3/c1-15(2,3)22-14(24)13(23)21-9-4-5-10(12-7-20-8-25-12)11(6-9)16(17,18)19/h4-8H,1-3H3,(H,21,23)(H,22,24)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50127715 (3-Methoxy-4-oxazol-5-yl-phenylamine | 3-methoxy-4-...) Show SMILES COc1cc(N)ccc1-c1cnco1 Show InChI InChI=1S/C10H10N2O2/c1-13-9-4-7(11)2-3-8(9)10-5-12-6-14-10/h2-6H,11H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents	PubMed	n/a	n/a	1.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM19264 ((4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dih...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1C\C=C(/C)CCC(O)=O 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 KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair				3D Structure (crystal)
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50112571 (CHEMBL27985 | N-tert-Butyl-N'-(4-oxazol-5-yl-pheny...) Show SMILES CC(C)(C)NC(=O)C(=O)Nc1ccc(cc1)-c1cnco1 Show InChI InChI=1S/C15H17N3O3/c1-15(2,3)18-14(20)13(19)17-11-6-4-10(5-7-11)12-8-16-9-21-12/h4-9H,1-3H3,(H,17,19)(H,18,20)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220674 (CHEMBL44826) Show SMILES COc1ccc(NC(=O)C(=O)NC(C)(C)C)cc1OC Show InChI InChI=1S/C14H20N2O4/c1-14(2,3)16-13(18)12(17)15-9-6-7-10(19-4)11(8-9)20-5/h6-8H,1-5H3,(H,15,17)(H,16,18)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220614 (CHEMBL296923) Show SMILES CCCCc1ncoc1-c1ccc(NC(=O)C(=O)NC(C)(C)C)cc1OC Show InChI InChI=1S/C20H27N3O4/c1-6-7-8-15-17(27-12-21-15)14-10-9-13(11-16(14)26-5)22-18(24)19(25)23-20(2,3)4/h9-12H,6-8H2,1-5H3,(H,22,24)(H,23,25)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220676 (CHEMBL44551) Show SMILES COc1ccc(C#N)c2ccccc12 Show InChI InChI=1S/C12H9NO/c1-14-12-7-6-9(8-13)10-4-2-3-5-11(10)12/h2-7H,1H3	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220684 (CHEMBL296209) Show SMILES COc1ccc2[nH]cc(C(=O)CSc3ccncc3)c2c1 Show InChI InChI=1S/C16H14N2O2S/c1-20-11-2-3-15-13(8-11)14(9-18-15)16(19)10-21-12-4-6-17-7-5-12/h2-9,18H,10H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50127708 ((1H)-indole-3-carbonitrile | 1H-Indole-3-carbonitr...) Show SMILES N#Cc1c[nH]c2ccccc12 Show InChI InChI=1S/C9H6N2/c10-5-7-6-11-9-4-2-1-3-8(7)9/h1-4,6,11H	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents	PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220677 (CHEMBL45230) Show SMILES COc1cc(NC(=O)C(=O)NC(C)(C)C)ccc1-c1ocnc1Cc1ccccc1 Show InChI InChI=1S/C23H25N3O4/c1-23(2,3)26-22(28)21(27)25-16-10-11-17(19(13-16)29-4)20-18(24-14-30-20)12-15-8-6-5-7-9-15/h5-11,13-14H,12H2,1-4H3,(H,25,27)(H,26,28)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50127697 (4-hydroxycarbazole | 9H-Carbazol-4-ol | CHEMBL4672...) Show SMILES Oc1cccc2[nH]c3ccccc3c12 Show InChI InChI=1S/C12H9NO/c14-11-7-3-6-10-12(11)8-4-1-2-5-9(8)13-10/h1-7,13-14H	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	5.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220680 (CHEMBL45926) Show SMILES Cc1cc2OCC(C#N)C(=O)c2cc1C Show InChI InChI=1S/C12H11NO2/c1-7-3-10-11(4-8(7)2)15-6-9(5-13)12(10)14/h3-4,9H,6H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220678 (CHEMBL294926) Show SMILES N#Cc1ccc2[nH]ccc2c1 Show InChI InChI=1S/C9H6N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM23300 (4-amino-7-chloroquinoline (ACQ)-based compound, 5 ...) Show SMILES Nc1ccnc2cc(Cl)ccc12 Show InChI InChI=1S/C9H7ClN2/c10-6-1-2-7-8(11)3-4-12-9(7)5-6/h1-5H,(H2,11,12)	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Patents Similars	PubMed	n/a	n/a	1.68E+5	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1/2 (Homo sapiens (Human))	BDBM50220613 (CHEBI:87314 | CHEMBL47807) Show SMILES CC(=O)c1ccc(O)cc1C Show InChI InChI=1S/C9H10O2/c1-6-5-8(11)3-4-9(6)7(2)10/h3-5,11H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	6.20E+5	n/a	n/a	n/a	n/a	n/a	n/a
Roche Discovery Welwyn Curated by ChEMBL					Assay Description Inhibitory activity against (IMPDH) inosine 5'-monophosphate dehydrogenase				Bioorg Med Chem Lett 13: 1691-4 (2003) BindingDB Entry DOI: 10.7270/Q21N83B7
					More data for this Ligand-Target Pair