Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 4/G1/S-specific cyclin-D3' and Ligand = 'BDBM50244878'   

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
Cyclin-dependent kinase 4/G1/S-specific cyclin-D3 (Homo sapiens (Human))	BDBM50244878 (CHEMBL4066542) Show SMILES COC(=O)CCCCCCC(=O)Nc1ccccc1Nc1ncc2cc(C(=O)N(C)C)n(C3CCCC3)c2n1 Show InChI InChI=1S/C29H38N6O4/c1-34(2)28(38)24-18-20-19-30-29(33-27(20)35(24)21-12-8-9-13-21)32-23-15-11-10-14-22(23)31-25(36)16-6-4-5-7-17-26(37)39-3/h10-11,14-15,18-19,21H,4-9,12-13,16-17H2,1-3H3,(H,31,36)(H,30,32,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Nankai University Curated by ChEMBL					Assay Description Binding affinity towards [3H]quipazine labeled 5-hydroxytryptamine 3 receptor sites in HG108-15				J Med Chem 61: 3166-3192 (2018) Article DOI: 10.1021/acs.jmedchem.8b00209 BindingDB Entry DOI: 10.7270/Q2KS6TZK
					More data for this Ligand-Target Pair