Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Cyclin-dependent kinase 4/G1/S-specific cyclin-D1' and Ligand = 'BDBM462106'   

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-D1 (Homo sapiens (Human))	BDBM462106 (US10766884, Example A23 | US10766884, Example A24 ...) Show SMILES CC(C)n1c(nc2c(F)cc(cc12)-c1nc(N[C@@H]2CCOC[C@H]2O)ncc1Cl)C(C)(O)C1CC1 |r| Show InChI InChI=1S/C24H29ClFN5O3/c1-12(2)31-18-9-13(8-16(26)21(18)29-22(31)24(3,33)14-4-5-14)20-15(25)10-27-23(30-20)28-17-6-7-34-11-19(17)32/h8-10,12,14,17,19,32-33H,4-7,11H2,1-3H3,(H,27,28,30)/t17-,19-,24?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The purpose CDK4/Cyclin D1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) in the presence of small molecule inhibitors by us...				Citation and Details BindingDB Entry DOI: 10.7270/Q2XG9V9M
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 4/G1/S-specific cyclin-D1 (Homo sapiens (Human))	BDBM462106 (US10766884, Example A23 | US10766884, Example A24 ...) Show SMILES CC(C)n1c(nc2c(F)cc(cc12)-c1nc(N[C@@H]2CCOC[C@H]2O)ncc1Cl)C(C)(O)C1CC1 |r| Show InChI InChI=1S/C24H29ClFN5O3/c1-12(2)31-18-9-13(8-16(26)21(18)29-22(31)24(3,33)14-4-5-14)20-15(25)10-27-23(30-20)28-17-6-7-34-11-19(17)32/h8-10,12,14,17,19,32-33H,4-7,11H2,1-3H3,(H,27,28,30)/t17-,19-,24?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	0.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. US Patent					Assay Description CDK4/Cyclin D1: The purpose CDK4/Cyclin D1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) in the presence of small molecule ...				US Patent US10766884 (2020) BindingDB Entry DOI: 10.7270/Q23F4SQG
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 4/G1/S-specific cyclin-D1 (Homo sapiens (Human))	BDBM462106 (US10766884, Example A23 | US10766884, Example A24 ...) Show SMILES CC(C)n1c(nc2c(F)cc(cc12)-c1nc(N[C@@H]2CCOC[C@H]2O)ncc1Cl)C(C)(O)C1CC1 |r| Show InChI InChI=1S/C24H29ClFN5O3/c1-12(2)31-18-9-13(8-16(26)21(18)29-22(31)24(3,33)14-4-5-14)20-15(25)10-27-23(30-20)28-17-6-7-34-11-19(17)32/h8-10,12,14,17,19,32-33H,4-7,11H2,1-3H3,(H,27,28,30)/t17-,19-,24?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description The purpose CDK4/Cyclin D1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) in the presence of small molecule inhibitors by us...				Citation and Details BindingDB Entry DOI: 10.7270/Q2XG9V9M
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 4/G1/S-specific cyclin-D1 (Homo sapiens (Human))	BDBM462106 (US10766884, Example A23 | US10766884, Example A24 ...) Show SMILES CC(C)n1c(nc2c(F)cc(cc12)-c1nc(N[C@@H]2CCOC[C@H]2O)ncc1Cl)C(C)(O)C1CC1 |r| Show InChI InChI=1S/C24H29ClFN5O3/c1-12(2)31-18-9-13(8-16(26)21(18)29-22(31)24(3,33)14-4-5-14)20-15(25)10-27-23(30-20)28-17-6-7-34-11-19(17)32/h8-10,12,14,17,19,32-33H,4-7,11H2,1-3H3,(H,27,28,30)/t17-,19-,24?/m1/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. US Patent					Assay Description CDK4/Cyclin D1: The purpose CDK4/Cyclin D1 assay is to evaluate the inhibition (% inhibition, Kiapp and Ki values) in the presence of small molecule ...				US Patent US10766884 (2020) BindingDB Entry DOI: 10.7270/Q23F4SQG
					More data for this Ligand-Target Pair