BDBM50378807 CHEMBL1223412

SMILES: Cn1c2nc(NCc3cccc(N)c3)ncc2cc(-c2ccccc2Br)c1=O

InChI Key: InChIKey=XRICZAYMCVEQRW-UHFFFAOYSA-N

Data: 1 KI

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 = 50378807   

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
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM50378807 (CHEMBL1223412) Show SMILES Cn1c2nc(NCc3cccc(N)c3)ncc2cc(-c2ccccc2Br)c1=O Show InChI InChI=1S/C21H18BrN5O/c1-27-19-14(10-17(20(27)28)16-7-2-3-8-18(16)22)12-25-21(26-19)24-11-13-5-4-6-15(23)9-13/h2-10,12H,11,23H2,1H3,(H,24,25,26)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Iowa State University Curated by ChEMBL					Assay Description Inhibition of recombinant c-Abl after 30 mins				Bioorg Med Chem 18: 6316-21 (2010) Article DOI: 10.1016/j.bmc.2010.07.021 BindingDB Entry DOI: 10.7270/Q2CZ384X
					More data for this Ligand-Target Pair