BDBM50169894 3-{6-[4-(3-Chloro-phenylamino)-[1,3,5]triazin-2-yl]-pyrazin-2-ylamino}-propan-1-ol::CHEMBL193029

SMILES: OCCCNc1cncc(n1)-c1ncnc(Nc2cccc(Cl)c2)n1

InChI Key: InChIKey=YCIKQCSHPXFBJU-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 = 50169894   

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))	BDBM50169894 (3-{6-[4-(3-Chloro-phenylamino)-[1,3,5]triazin-2-yl...) Show SMILES OCCCNc1cncc(n1)-c1ncnc(Nc2cccc(Cl)c2)n1 Show InChI InChI=1S/C16H16ClN7O/c17-11-3-1-4-12(7-11)22-16-21-10-20-15(24-16)13-8-18-9-14(23-13)19-5-2-6-25/h1,3-4,7-10,25H,2,5-6H2,(H,19,23)(H,20,21,22,24)	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	>1.00E+4	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))	BDBM50169894 (3-{6-[4-(3-Chloro-phenylamino)-[1,3,5]triazin-2-yl...) Show SMILES OCCCNc1cncc(n1)-c1ncnc(Nc2cccc(Cl)c2)n1 Show InChI InChI=1S/C16H16ClN7O/c17-11-3-1-4-12(7-11)22-16-21-10-20-15(24-16)13-8-18-9-14(23-13)19-5-2-6-25/h1,3-4,7-10,25H,2,5-6H2,(H,19,23)(H,20,21,22,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	971	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