BDBM50246486 CHEMBL4083663

SMILES: Fc1ccc(Oc2ccnc3cc(ccc23)-c2cnn(c2)C2CCNCC2)cc1F

InChI Key: InChIKey=FWIBRURKFFCMBI-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50246486   

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
ALK tyrosine kinase receptor (Homo sapiens (Human))	BDBM50246486 (CHEMBL4083663) Show SMILES Fc1ccc(Oc2ccnc3cc(ccc23)-c2cnn(c2)C2CCNCC2)cc1F Show InChI InChI=1S/C23H20F2N4O/c24-20-4-2-18(12-21(20)25)30-23-7-10-27-22-11-15(1-3-19(22)23)16-13-28-29(14-16)17-5-8-26-9-6-17/h1-4,7,10-14,17,26H,5-6,8-9H2	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	148	n/a	n/a	n/a	n/a	n/a	n/a
Korea Advanced Institute of Science and Technology (KAIST) Curated by ChEMBL					Assay Description Inhibition of human wild type ALK using YRRAAVPPSPSLSRHSSPHQ(pS)EDEEE as substrate preincubated for 20 mins followed by [gamma-33P]-ATP addition afte...				J Med Chem 60: 9205-9221 (2017) Article DOI: 10.1021/acs.jmedchem.7b01039 BindingDB Entry DOI: 10.7270/Q26D5WF3
					More data for this Ligand-Target Pair