BDBM29897 substituted 6-aminoquinoline-3-carbonitrile, 7

SMILES: Fc1ccc(Nc2c(cnc3c(Cl)cc(NCc4cnn[nH]4)cc23)C#N)cc1Cl

InChI Key: InChIKey=IKMGVUYZBWHRNX-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 29897   

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
Mitogen-activated protein kinase kinase kinase 8 (Homo sapiens (Human))	BDBM29897 (substituted 6-aminoquinoline-3-carbonitrile, 7) Show SMILES Fc1ccc(Nc2c(cnc3c(Cl)cc(NCc4cnn[nH]4)cc23)C#N)cc1Cl Show InChI InChI=1S/C19H12Cl2FN7/c20-15-4-11(1-2-17(15)22)27-18-10(6-23)7-25-19-14(18)3-12(5-16(19)21)24-8-13-9-26-29-28-13/h1-5,7,9,24H,8H2,(H,25,27)(H,26,28,29)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	7.2	30
Wyeth Research					Assay Description Tpl2/Cot activity was directly assayed using GST-MEK1 as a substrate. The phosphorylation on serine residues 217 and 221 of GST-MEK1 was detected by ...				Bioorg Med Chem Lett 19: 3485-8 (2009) Article DOI: 10.1016/j.bmcl.2009.05.009 BindingDB Entry DOI: 10.7270/Q2HT2MN8
					More data for this Ligand-Target Pair