BDBM50517548 CHEMBL4460381

SMILES: COc1cc(Nc2ncnc3cc(sc23)-c2cccs2)cc(OC)c1OC

InChI Key: InChIKey=ZDRDDLAPYKXFRU-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50517548   

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))	BDBM50517548 (CHEMBL4460381) Show SMILES COc1cc(Nc2ncnc3cc(sc23)-c2cccs2)cc(OC)c1OC Show InChI InChI=1S/C19H17N3O3S2/c1-23-13-7-11(8-14(24-2)17(13)25-3)22-19-18-12(20-10-21-19)9-16(27-18)15-5-4-6-26-15/h4-10H,1-3H3,(H,20,21,22)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Ferrara Curated by ChEMBL					Assay Description Inhibition of wild type VEGFR2 (unknown origin) by bioluminescent ADP-glo kinase assay				J Med Chem 62: 1274-1290 (2019) Article DOI: 10.1021/acs.jmedchem.8b01391
					More data for this Ligand-Target Pair
Similar to alpha-tubulin isoform 1 (Bos taurus)	BDBM50517548 (CHEMBL4460381) Show SMILES COc1cc(Nc2ncnc3cc(sc23)-c2cccs2)cc(OC)c1OC Show InChI InChI=1S/C19H17N3O3S2/c1-23-13-7-11(8-14(24-2)17(13)25-3)22-19-18-12(20-10-21-19)9-16(27-18)15-5-4-6-26-15/h4-10H,1-3H3,(H,20,21,22)	UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Ferrara Curated by ChEMBL					Assay Description Inhibition of bovine brain tubulin polymerization after 20 mins				J Med Chem 62: 1274-1290 (2019) Article DOI: 10.1021/acs.jmedchem.8b01391
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50517548 (CHEMBL4460381) Show SMILES COc1cc(Nc2ncnc3cc(sc23)-c2cccs2)cc(OC)c1OC Show InChI InChI=1S/C19H17N3O3S2/c1-23-13-7-11(8-14(24-2)17(13)25-3)22-19-18-12(20-10-21-19)9-16(27-18)15-5-4-6-26-15/h4-10H,1-3H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Ferrara Curated by ChEMBL					Assay Description Inhibition of wild type EGFR (unknown origin) by bioluminescent ADP-glo kinase assay				J Med Chem 62: 1274-1290 (2019) Article DOI: 10.1021/acs.jmedchem.8b01391
					More data for this Ligand-Target Pair