Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase/G1/S-specific cyclin- 2' and Ligand = 'BDBM50464608'   

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/G1/S-specific cyclin- 2 (Homo sapiens (Human))	BDBM50464608 (CHEMBL4278904 | US11091476, Example 19) Show SMILES CCN1CCN(CC1)c1ccc(Nc2ncc(F)c(n2)-c2cc3c(N=C(C)C3(C)CC)c(F)c2)nc1 |t:26| Show InChI InChI=1S/C27H31F2N7/c1-5-27(4)17(3)32-25-20(27)13-18(14-21(25)28)24-22(29)16-31-26(34-24)33-23-8-7-19(15-30-23)36-11-9-35(6-2)10-12-36/h7-8,13-16H,5-6,9-12H2,1-4H3,(H,30,31,33,34)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	64.8	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description 1.2.2 Preparation of kinase solution: Kinase solutions having the concentrations required for each reaction system were prepared from 100 ng/...				Citation and Details BindingDB Entry DOI: 10.7270/Q2H13552
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