BDBM6271 8-(2,3-Dihydroxypropyl)-2-[4-(4-methylpiperazin-1-yl)phenylamino]-8H-pyrido[2,3-d]pyrimidin-7-one::8-(2,3-dihydroxypropyl)-2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-7H,8H-pyrido[2,3-d]pyrimidin-7-one::N8 Pyrido[2,3-d]pyrimidin-7-one deriv. 63

SMILES: CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(O)CO)c3n2)cc1

InChI Key: InChIKey=SFOPDWSVOIGXPH-UHFFFAOYSA-N

Data: 1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 6271   

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
Cyclin-Dependent Kinase 4 (CDK4) (Homo sapiens (Human))	BDBM6271 (8-(2,3-Dihydroxypropyl)-2-[4-(4-methylpiperazin-1-...) Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3ccc(=O)n(CC(O)CO)c3n2)cc1 Show InChI InChI=1S/C21H26N6O3/c1-25-8-10-26(11-9-25)17-5-3-16(4-6-17)23-21-22-12-15-2-7-19(30)27(20(15)24-21)13-18(29)14-28/h2-7,12,18,28-29H,8-11,13-14H2,1H3,(H,22,23,24)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.65E+3	n/a	n/a	n/a	n/a	n/a	n/a
Parke-Davis Pharmaceutical Research					Assay Description The enzyme was assayed with substrate GST- retinoblastoma in the presence of 25 uM ATP/[gamma-32P] ATP. IC50 is the inhibitor concentration, which in...				J Med Chem 43: 4606-16 (2000) Article DOI: 10.1021/jm000271k BindingDB Entry DOI: 10.7270/Q25B00N4
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