Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with all data for entry = 50035978   

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
Cytidine deaminase (Homo sapiens (Human))	BDBM50087289 (1-beta-D-Arabinofuranosylcytosine | 4-Amino-1-beta...) Show SMILES Nc1ccn([C@@H]2O[C@H](CO)[C@@H](O)[C@@H]2O)c(=O)n1 |r| Show InChI InChI=1S/C9H13N3O5/c10-5-1-2-12(9(16)11-5)8-7(15)6(14)4(3-13)17-8/h1-2,4,6-8,13-15H,3H2,(H2,10,11,16)/t4-,6-,7+,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE KEGG MMDB PC cid PC sid PDB UniChem Patents Similars	DrugBank PubMed	1.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Inhibitory constant was measured on cytidine/deoxycytidine deaminase				J Med Chem 34: 2607-15 (1991) BindingDB Entry DOI: 10.7270/Q23F4Q8T
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50007155 (4-Amino-1-(3-hydroxy-5-hydroxymethyl-4-methylene-t...) Show SMILES Nc1ccn(C2OC(CO)C(=C)C2O)c(=O)n1 Show InChI InChI=1S/C10H13N3O4/c1-5-6(4-14)17-9(8(5)15)13-3-2-7(11)12-10(13)16/h2-3,6,8-9,14-15H,1,4H2,(H2,11,12,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.60E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Inhibitory constant was measured on cytidine/deoxycytidine deaminase				J Med Chem 34: 2607-15 (1991) BindingDB Entry DOI: 10.7270/Q23F4Q8T
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50421893 (CHEMBL10128) Show SMILES Nc1ccn(C2O[C@H](CO)[C@H](O)C2=C)c(=O)n1 Show InChI InChI=1S/C10H13N3O4/c1-5-8(15)6(4-14)17-9(5)13-3-2-7(11)12-10(13)16/h2-3,6,8-9,14-15H,1,4H2,(H2,11,12,16)/t6-,8-,9?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	7.69E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Inhibitory constant was measured on cytidine/deoxycytidine deaminase				J Med Chem 34: 2607-15 (1991) BindingDB Entry DOI: 10.7270/Q23F4Q8T
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50007156 (4-Amino-5-fluoro-1-(4-hydroxy-5-hydroxymethyl-3-me...) Show SMILES Nc1nc(=O)n(cc1F)[C@@H]1O[C@H](CO)[C@@H](O)C1=C |r| Show InChI InChI=1S/C10H12FN3O4/c1-4-7(16)6(3-15)18-9(4)14-2-5(11)8(12)13-10(14)17/h2,6-7,9,15-16H,1,3H2,(H2,12,13,17)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.51E+7	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Yale University Curated by ChEMBL					Assay Description Inhibitory constant was measured on cytidine/deoxycytidine deaminase				J Med Chem 34: 2607-15 (1991) BindingDB Entry DOI: 10.7270/Q23F4Q8T
					More data for this Ligand-Target Pair