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SMILES: Brc1ccc2ncnc(NCc3ccccc3)c2c1

InChI Key: InChIKey=CRIVWOZDTPNCTP-UHFFFAOYSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50257751   

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
Xylosyl- and glucuronyltransferase LARGE1 (Homo sapiens (Human))	BDBM50257751 (CHEMBL494326 | N-benzyl-6-bromoquinazolin-4-amine ...) Show SMILES Brc1ccc2ncnc(NCc3ccccc3)c2c1 Show InChI InChI=1S/C15H12BrN3/c16-12-6-7-14-13(8-12)15(19-10-18-14)17-9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,17,18,19)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	3.34E+3	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2VT1QQ4
					More data for this Ligand-Target Pair
Huntingtin (Homo sapiens (Human))	BDBM50257751 (CHEMBL494326 | N-benzyl-6-bromoquinazolin-4-amine ...) Show SMILES Brc1ccc2ncnc(NCc3ccccc3)c2c1 Show InChI InChI=1S/C15H12BrN3/c16-12-6-7-14-13(8-12)15(19-10-18-14)17-9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,17,18,19)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of Huntingtin protein (unknown origin) aggregation by yeast based assay				Bioorg Med Chem Lett 19: 1715-7 (2009) Article DOI: 10.1016/j.bmcl.2009.01.087 BindingDB Entry DOI: 10.7270/Q2Q2403P
					More data for this Ligand-Target Pair
Huntingtin (Homo sapiens (Human))	BDBM50257751 (CHEMBL494326 | N-benzyl-6-bromoquinazolin-4-amine ...) Show SMILES Brc1ccc2ncnc(NCc3ccccc3)c2c1 Show InChI InChI=1S/C15H12BrN3/c16-12-6-7-14-13(8-12)15(19-10-18-14)17-9-11-4-2-1-3-5-11/h1-8,10H,9H2,(H,17,18,19)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
Columbia University Curated by ChEMBL					Assay Description Inhibition of Huntingtin protein aggregation by cell based assay				Bioorg Med Chem Lett 19: 1715-7 (2009) Article DOI: 10.1016/j.bmcl.2009.01.087 BindingDB Entry DOI: 10.7270/Q2Q2403P
					More data for this Ligand-Target Pair