BDBM50169896 3-{5-[4-(2,3-Dihydro-benzo[1,4]dioxin-6-ylamino)-[1,3,5]triazin-2-yl]-pyridin-3-ylamino}-propan-1-ol::CHEMBL363590

SMILES: OCCCNc1cncc(c1)-c1ncnc(Nc2ccc3OCCOc3c2)n1

InChI Key: InChIKey=NDADSQVDVRXBPR-UHFFFAOYSA-N

Data: 2 IC50

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 = 50169896   

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
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50169896 (3-{5-[4-(2,3-Dihydro-benzo[1,4]dioxin-6-ylamino)-[...) Show SMILES OCCCNc1cncc(c1)-c1ncnc(Nc2ccc3OCCOc3c2)n1 Show InChI InChI=1S/C19H20N6O3/c26-5-1-4-21-15-8-13(10-20-11-15)18-22-12-23-19(25-18)24-14-2-3-16-17(9-14)28-7-6-27-16/h2-3,8-12,21,26H,1,4-7H2,(H,22,23,24,25)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	4.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibition of vascular endothelial growth factor receptor 2				J Med Chem 48: 4535-46 (2005) Article DOI: 10.1021/jm040214h BindingDB Entry DOI: 10.7270/Q2833RK0
					More data for this Ligand-Target Pair
Cyclin-dependent kinase 1 (Homo sapiens (Human))	BDBM50169896 (3-{5-[4-(2,3-Dihydro-benzo[1,4]dioxin-6-ylamino)-[...) Show SMILES OCCCNc1cncc(c1)-c1ncnc(Nc2ccc3OCCOc3c2)n1 Show InChI InChI=1S/C19H20N6O3/c26-5-1-4-21-15-8-13(10-20-11-15)18-22-12-23-19(25-18)24-14-2-3-16-17(9-14)28-7-6-27-16/h2-3,8-12,21,26H,1,4-7H2,(H,22,23,24,25)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	344	n/a	n/a	n/a	n/a	n/a	n/a
Johnson & Johnson Pharmaceutical Research and Development Curated by ChEMBL					Assay Description Inhibition of cyclin dependent kinase (CDK1)				J Med Chem 48: 4535-46 (2005) Article DOI: 10.1021/jm040214h BindingDB Entry DOI: 10.7270/Q2833RK0
					More data for this Ligand-Target Pair