BDBM50201230 4-(2,4-dichloro-5-methoxyphenylamino)-6-ethoxy-7-(4-(4-methylpiperazin-1-yl)but-1-ynyl)quinoline-3-carbonitrile::CHEMBL240830

SMILES: CCOc1cc2c(Nc3cc(OC)c(Cl)cc3Cl)c(cnc2cc1C#CCCN1CCN(C)CC1)C#N

InChI Key: InChIKey=VKGWONFLJDZUKM-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 = 50201230   

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
Proto-oncogene tyrosine-protein kinase Src (Rattus norvegicus)	BDBM50201230 (4-(2,4-dichloro-5-methoxyphenylamino)-6-ethoxy-7-(...) Show SMILES CCOc1cc2c(Nc3cc(OC)c(Cl)cc3Cl)c(cnc2cc1C#CCCN1CCN(C)CC1)C#N Show InChI InChI=1S/C28H29Cl2N5O2/c1-4-37-26-14-21-24(13-19(26)7-5-6-8-35-11-9-34(2)10-12-35)32-18-20(17-31)28(21)33-25-16-27(36-3)23(30)15-22(25)29/h13-16,18H,4,6,8-12H2,1-3H3,(H,32,33)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of Src in rat fibroblasts				Bioorg Med Chem Lett 17: 1358-61 (2007) Article DOI: 10.1016/j.bmcl.2006.11.077 BindingDB Entry DOI: 10.7270/Q2SJ1K7T
					More data for this Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase Src (Homo sapiens (Human))	BDBM50201230 (4-(2,4-dichloro-5-methoxyphenylamino)-6-ethoxy-7-(...) Show SMILES CCOc1cc2c(Nc3cc(OC)c(Cl)cc3Cl)c(cnc2cc1C#CCCN1CCN(C)CC1)C#N Show InChI InChI=1S/C28H29Cl2N5O2/c1-4-37-26-14-21-24(13-19(26)7-5-6-8-35-11-9-34(2)10-12-35)32-18-20(17-31)28(21)33-25-16-27(36-3)23(30)15-22(25)29/h13-16,18H,4,6,8-12H2,1-3H3,(H,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	4.10	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of Src activity				Bioorg Med Chem Lett 17: 1358-61 (2007) Article DOI: 10.1016/j.bmcl.2006.11.077 BindingDB Entry DOI: 10.7270/Q2SJ1K7T
					More data for this Ligand-Target Pair