BDBM8063 2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 34::4-(2,4-dimethyl-1,3-thiazol-5-yl)-N-(4-nitrophenyl)pyrimidin-2-amine::[4-(2,4-Dimethylthiazol-5-yl)pyrimidin-2-yl](4-nitrophenyl)amine

SMILES: Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N(=O)=O)n1

InChI Key: InChIKey=XSCMYZSBESWDML-UHFFFAOYSA-N

Data: 2 KI

PDB links: 5 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 8063   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
CDK2/CycE (Homo sapiens (Human))	BDBM8063 (2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 34 | 4...) Show SMILES Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N(=O)=O)n1 Show InChI InChI=1S/C15H13N5O2S/c1-9-14(23-10(2)17-9)13-7-8-16-15(19-13)18-11-3-5-12(6-4-11)20(21)22/h3-8H,1-2H3,(H,16,18,19)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	4.10E+3	-7.47	n/a	n/a	n/a	n/a	n/a	n/a	30
Cyclacel Limited					Assay Description In vitro kinase assay using purified enzyme, was incubated at 30 °C with substrate, and test compounds in the presence of 100 uM ATP/ [gamma-32P...				J Med Chem 47: 1662-75 (2004) Article DOI: 10.1021/jm0309957 BindingDB Entry DOI: 10.7270/Q2H993DD
					More data for this Ligand-Target Pair
Cyclin-Dependent Kinase 4 (CDK4) (Homo sapiens (Human))	BDBM8063 (2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 34 | 4...) Show SMILES Cc1nc(C)c(s1)-c1ccnc(Nc2ccc(cc2)N(=O)=O)n1 Show InChI InChI=1S/C15H13N5O2S/c1-9-14(23-10(2)17-9)13-7-8-16-15(19-13)18-11-3-5-12(6-4-11)20(21)22/h3-8H,1-2H3,(H,16,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem Patents Similars	Article PubMed	>2.00E+4	>-6.51	n/a	n/a	n/a	n/a	n/a	n/a	30
Cyclacel Limited					Assay Description In vitro kinase assay using purified enzyme, was incubated at 30 °C with substrate, and test compounds in the presence of 100 uM ATP/ [gamma-32P...				J Med Chem 47: 1662-75 (2004) Article DOI: 10.1021/jm0309957 BindingDB Entry DOI: 10.7270/Q2H993DD
					More data for this Ligand-Target Pair