Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 1/G1/S-specific cyclin-D3' and Ligand = 'BDBM50464639'   

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 1/G1/S-specific cyclin-D3 (Homo sapiens (Human))	BDBM50464639 (CHEMBL4291740 | US11091476, Example 1) Show SMILES CC1=Nc2c(cc(cc2F)-c2nc(Nc3ccc(cn3)N3CCNCC3)ncc2F)C1(C)C |t:1| Show InChI InChI=1S/C24H25F2N7/c1-14-24(2,3)17-10-15(11-18(25)22(17)30-14)21-19(26)13-29-23(32-21)31-20-5-4-16(12-28-20)33-8-6-27-7-9-33/h4-5,10-13,27H,6-9H2,1-3H3,(H,28,29,31,32)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	245	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
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1/G1/S-specific cyclin-D3 (Homo sapiens (Human))	BDBM50464639 (CHEMBL4291740 | US11091476, Example 1) Show SMILES CC1=Nc2c(cc(cc2F)-c2nc(Nc3ccc(cn3)N3CCNCC3)ncc2F)C1(C)C |t:1| Show InChI InChI=1S/C24H25F2N7/c1-14-24(2,3)17-10-15(11-18(25)22(17)30-14)21-19(26)13-29-23(32-21)31-20-5-4-16(12-28-20)33-8-6-27-7-9-33/h4-5,10-13,27H,6-9H2,1-3H3,(H,28,29,31,32)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	245	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
					More data for this Ligand-Target Pair