BDBM50429677 CHEMBL2335017

SMILES: CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1

InChI Key: InChIKey=KVGUDVKUMFSIEI-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50429677   

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
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50429677 (CHEMBL2335017) Show SMILES CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1 Show InChI InChI=1S/C26H26N6O/c1-5-17-9-8-11-19(15-17)28-22-21-16-20(13-12-18-10-6-7-14-27-18)29-23(21)31-25(30-22)32-24(33)26(2,3)4/h1,6-11,14-16H,12-13H2,2-4H3,(H3,28,29,30,31,32,33)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of EGF-induced EGFR phosphorylation in human A431 cells overexpressing EGFR pretreated for 60 mins prior to EGF addition measured after 10...				Bioorg Med Chem 21: 1312-23 (2013) Article DOI: 10.1016/j.bmc.2012.12.045 BindingDB Entry DOI: 10.7270/Q25140KN
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 2 (Homo sapiens (Human))	BDBM50429677 (CHEMBL2335017) Show SMILES CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1 Show InChI InChI=1S/C26H26N6O/c1-5-17-9-8-11-19(15-17)28-22-21-16-20(13-12-18-10-6-7-14-27-18)29-23(21)31-25(30-22)32-24(33)26(2,3)4/h1,6-11,14-16H,12-13H2,2-4H3,(H3,28,29,30,31,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.26E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of VEGF-induced VEGFR2 phosphorylation in human U251 cells overexpressing Flk-1 pretreated for 60 mins prior to VEGF addition measured aft...				Bioorg Med Chem 21: 1312-23 (2013) Article DOI: 10.1016/j.bmc.2012.12.045 BindingDB Entry DOI: 10.7270/Q25140KN
					More data for this Ligand-Target Pair
Vascular endothelial growth factor receptor 1 (Homo sapiens (Human))	BDBM50429677 (CHEMBL2335017) Show SMILES CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1 Show InChI InChI=1S/C26H26N6O/c1-5-17-9-8-11-19(15-17)28-22-21-16-20(13-12-18-10-6-7-14-27-18)29-23(21)31-25(30-22)32-24(33)26(2,3)4/h1,6-11,14-16H,12-13H2,2-4H3,(H3,28,29,30,31,32,33)	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.56E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of VEGF-induced VEGFR1 phosphorylation in human A498 cells overexpressing Flt-1 pretreated for 60 mins prior to VEGF addition measured aft...				Bioorg Med Chem 21: 1312-23 (2013) Article DOI: 10.1016/j.bmc.2012.12.045 BindingDB Entry DOI: 10.7270/Q25140KN
					More data for this Ligand-Target Pair
Platelet-derived growth factor receptor beta (Homo sapiens (Human))	BDBM50429677 (CHEMBL2335017) Show SMILES CC(C)(C)C(=O)Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccn3)[nH]c2n1 Show InChI InChI=1S/C26H26N6O/c1-5-17-9-8-11-19(15-17)28-22-21-16-20(13-12-18-10-6-7-14-27-18)29-23(21)31-25(30-22)32-24(33)26(2,3)4/h1,6-11,14-16H,12-13H2,2-4H3,(H3,28,29,30,31,32,33)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.30E+5	n/a	n/a	n/a	n/a	n/a	n/a
Duquesne University Curated by ChEMBL					Assay Description Inhibition of PDGF-BB-induced PDGFR beta phosphorylation in human SF539 cells overexpressing PDGFR beta pretreated for 60 mins prior to PDGF-BB addit...				Bioorg Med Chem 21: 1312-23 (2013) Article DOI: 10.1016/j.bmc.2012.12.045 BindingDB Entry DOI: 10.7270/Q25140KN
					More data for this Ligand-Target Pair