Compile Data Set for Download or QSAR

Found 12 hits with Last Name = 'allison' and Initial = 'ac'   

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 1 (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 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 PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010605 (6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CCCCCC(O)=O Show InChI InChI=1S/C16H20O6/c1-9-11-8-22-16(20)13(11)14(19)10(15(9)21-2)6-4-3-5-7-12(17)18/h19H,3-8H2,1-2H3,(H,17,18)	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	940	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010602 (3-[2-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihyd...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CC1CC1(C)CCC(O)=O Show InChI InChI=1S/C18H22O6/c1-9-12-8-24-17(22)14(12)15(21)11(16(9)23-3)6-10-7-18(10,2)5-4-13(19)20/h10,21H,4-8H2,1-3H3,(H,19,20)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010604 (7-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CC=C=C(C)CCC(O)=O |(6.21,-15.73,;6.21,-14.19,;4.88,-13.42,;3.53,-14.19,;3.53,-15.73,;2.2,-13.42,;.75,-13.91,;-.16,-12.67,;.73,-11.42,;.26,-9.96,;2.2,-11.88,;3.53,-11.11,;3.53,-9.57,;4.88,-11.88,;6.21,-11.11,;7.54,-11.86,;8.87,-11.09,;10.2,-11.86,;10.2,-13.4,;11.55,-11.09,;12.88,-11.86,;14.21,-11.11,;15.55,-11.88,;14.22,-9.57,)| Show InChI InChI=1S/C18H20O6/c1-10(7-8-14(19)20)5-4-6-12-16(21)15-13(9-24-18(15)22)11(2)17(12)23-3/h4,21H,6-9H2,1-3H3,(H,19,20)	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	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010609 (7-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CCCCCCC(O)=O Show InChI InChI=1S/C17H22O6/c1-10-12-9-23-17(21)14(12)15(20)11(16(10)22-2)7-5-3-4-6-8-13(18)19/h20H,3-9H2,1-2H3,(H,18,19)	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	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010611 (6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1C\C=C\CCC(O)=O Show InChI InChI=1S/C16H18O6/c1-9-11-8-22-16(20)13(11)14(19)10(15(9)21-2)6-4-3-5-7-12(17)18/h3-4,19H,5-8H2,1-2H3,(H,17,18)/b4-3+	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	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010612 (7-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CC#CCCCC(O)=O Show InChI InChI=1S/C17H18O6/c1-10-12-9-23-17(21)14(12)15(20)11(16(10)22-2)7-5-3-4-6-8-13(18)19/h20H,4,6-9H2,1-2H3,(H,18,19)	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	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010610 (3-[2,2-Difluoro-3-(4-hydroxy-6-methoxy-7-methyl-3-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CC1C(F)(F)C1(C)CCC(O)=O Show InChI InChI=1S/C18H20F2O6/c1-8-10-7-26-16(24)13(10)14(23)9(15(8)25-3)6-11-17(2,18(11,19)20)5-4-12(21)22/h11,23H,4-7H2,1-3H3,(H,21,22)	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	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010606 (6-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CC#CCCC(O)=O Show InChI InChI=1S/C16H16O6/c1-9-11-8-22-16(20)13(11)14(19)10(15(9)21-2)6-4-3-5-7-12(17)18/h19H,5-8H2,1-2H3,(H,17,18)	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	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010603 (3-[2,2-Dibromo-3-(4-hydroxy-6-methoxy-7-methyl-3-o...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CC1C(Br)(Br)C1(C)CCC(O)=O Show InChI InChI=1S/C18H20Br2O6/c1-8-10-7-26-16(24)13(10)14(23)9(15(8)25-3)6-11-17(2,18(11,19)20)5-4-12(21)22/h11,23H,4-7H2,1-3H3,(H,21,22)	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	3.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010608 (3-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CSCCC(O)=O Show InChI InChI=1S/C14H16O6S/c1-7-8-5-20-14(18)11(8)12(17)9(13(7)19-2)6-21-4-3-10(15)16/h17H,3-6H2,1-2H3,(H,15,16)	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	1.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair
Inosine-5'-monophosphate dehydrogenase 1 (Homo sapiens (Human))	BDBM50010607 (4-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-...) Show SMILES COc1c(C)c2COC(=O)c2c(O)c1CSCCCC(O)=O Show InChI InChI=1S/C15H18O6S/c1-8-9-6-21-15(19)12(9)13(18)10(14(8)20-2)7-22-5-3-4-11(16)17/h18H,3-7H2,1-2H3,(H,16,17)	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	2.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
Syntex Research Curated by ChEMBL					Assay Description In vitro inhibition of inosine Inosine-5'-monophosphate dehydrogenase				J Med Chem 33: 833-8 (1990) BindingDB Entry DOI: 10.7270/Q2TM7930
					More data for this Ligand-Target Pair