BDBM8055 2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 26::4-[4-(2-Amino-4-methylthiazol-5-yl)pyrimidin-2-ylamino]phenol::4-[4-(2-Amino-4-methylthiazol-5-yl)pyrimidin-2-ylamino]phenol, 7::4-{[4-(2-amino-4-methyl-1,3-thiazol-5-yl)pyrimidin-2-yl]amino}phenol

SMILES: Cc1nc(N)sc1-c1ccnc(Nc2ccc(O)cc2)n1

InChI Key: InChIKey=MUSBOHKPZFHPFH-UHFFFAOYSA-N

Data: 2 KI  1 IC50

PDB links: 1 PDB ID contains this monomer as substructures. 1 PDB ID contains 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 3 hits for monomerid = 8055   

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))	BDBM8055 (2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 26 | 4...) Show SMILES Cc1nc(N)sc1-c1ccnc(Nc2ccc(O)cc2)n1 Show InChI InChI=1S/C14H13N5OS/c1-8-12(21-13(15)17-8)11-6-7-16-14(19-11)18-9-2-4-10(20)5-3-9/h2-7,20H,1H3,(H2,15,17)(H,16,18,19)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	30	-10.4	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))	BDBM8055 (2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 26 | 4...) Show SMILES Cc1nc(N)sc1-c1ccnc(Nc2ccc(O)cc2)n1 Show InChI InChI=1S/C14H13N5OS/c1-8-12(21-13(15)17-8)11-6-7-16-14(19-11)18-9-2-4-10(20)5-3-9/h2-7,20H,1H3,(H2,15,17)(H,16,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	320	-9.00	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
Serine/threonine-protein kinase PLK1 (Homo sapiens (Human))	BDBM8055 (2-Anilino-4-(thiazol-5-yl)pyrimidine deriv. 26 | 4...) Show SMILES Cc1nc(N)sc1-c1ccnc(Nc2ccc(O)cc2)n1 Show InChI InChI=1S/C14H13N5OS/c1-8-12(21-13(15)17-8)11-6-7-16-14(19-11)18-9-2-4-10(20)5-3-9/h2-7,20H,1H3,(H2,15,17)(H,16,18,19)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	2.50E+4	n/a	n/a	n/a	n/a	7.5	20
University of Cambridge									Nat Chem Biol 2: 608-17 (2006) Article DOI: 10.1038/nchembio825 BindingDB Entry DOI: 10.7270/Q29C6VS4
					More data for this Ligand-Target Pair