Compile Data Set for Download or QSAR

Found 6 hits Enz. Inhib. hit(s) with Target = 'Cytidine deaminase' and Ligand = 'BDBM50421666'   

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))	BDBM50421666 (CHEMBL2311128 | US9040501, 876404) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(O)NC1=O Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5?,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	100	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Cytidine Deaminase Inhibition in human liver				J Med Chem 23: 713-5 (1980) Checked by Author BindingDB Entry DOI: 10.7270/Q23N23ZN
					More data for this Ligand-Target Pair
Cytidine deaminase (Mus musculus)	BDBM50421666 (CHEMBL2311128 | US9040501, 876404) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(O)NC1=O Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5?,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	150	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested in vivo for its ability to inhibit mouse kidney cytidine deaminase (CDA)				J Med Chem 29: 2351-8 (1986) BindingDB Entry DOI: 10.7270/Q2GH9GZW
					More data for this Ligand-Target Pair
Cytidine deaminase (Mus musculus)	BDBM50421666 (CHEMBL2311128 | US9040501, 876404) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(O)NC1=O Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5?,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	220	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Cytidine Deaminase Inhibition in mouse Kidney				J Med Chem 23: 713-5 (1980) Checked by Author BindingDB Entry DOI: 10.7270/Q23N23ZN
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50421666 (CHEMBL2311128 | US9040501, 876404) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(O)NC1=O Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5?,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Harvard University Curated by ChEMBL					Assay Description Binding affinity for human cytidine deaminase				J Med Chem 48: 658-60 (2005) Article DOI: 10.1021/jm0496279 BindingDB Entry DOI: 10.7270/Q2M61M1J
					More data for this Ligand-Target Pair
Cytidine deaminase (Mus musculus)	BDBM50421666 (CHEMBL2311128 | US9040501, 876404) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(O)NC1=O Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5?,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	PubMed	400	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Compound was tested for the inhibitory constant for mouse kidney cytidine deaminase				J Med Chem 29: 1374-80 (1986) BindingDB Entry DOI: 10.7270/Q26T0N69
					More data for this Ligand-Target Pair
Cytidine deaminase (Homo sapiens (Human))	BDBM50421666 (CHEMBL2311128 | US9040501, 876404) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)N1CCC(O)NC1=O Show InChI InChI=1S/C9H16N2O6/c12-3-4-6(14)7(15)8(17-4)11-2-1-5(13)10-9(11)16/h4-8,12-15H,1-3H2,(H,10,16)/t4-,5?,6-,7-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	US Patent	n/a	n/a	113	n/a	n/a	n/a	n/a	7.4	n/a
Otsuka Pharmaceutical Co., Ltd. US Patent					Assay Description The cytidine deaminase (CDA) enzymatic assay described by Cacciamani, T. et al., Arch. Biochem. Biophys. 1991, 290, 285-92; Cohen R. et al., J. Biol....				US Patent US9040501 (2015) BindingDB Entry DOI: 10.7270/Q22R3QD1
					More data for this Ligand-Target Pair