BDBM50505659 CHEMBL4459524

SMILES: Cl.CC(C)(C)c1ccc(OCc2cn(C\C(F)=C\CN)nn2)cc1

InChI Key: InChIKey=DIMBDAIMEVNUKE-ZSOIEALJSA-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 = 50505659   

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
Protein-lysine 6-oxidase (Bos taurus)	BDBM50505659 (CHEMBL4459524) Show SMILES Cl.CC(C)(C)c1ccc(OCc2cn(C\C(F)=C\CN)nn2)cc1 Show InChI InChI=1S/C17H23FN4O/c1-17(2,3)13-4-6-16(7-5-13)23-12-15-11-22(21-20-15)10-14(18)8-9-19/h4-8,11H,9-10,12,19H2,1-3H3/b14-8-	MMDB Reactome pathway UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	501	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaxis Ltd Curated by ChEMBL					Assay Description Inhibition of LOX in bovine aorta using putrescine as substrate preincubated with enzyme for 30 mins followed by substrate addition and measured ever...				J Med Chem 62: 9874-9889 (2019) Article DOI: 10.1021/acs.jmedchem.9b01283
					More data for this Ligand-Target Pair
Lysyl oxidase homolog 2 (Homo sapiens (Human))	BDBM50505659 (CHEMBL4459524) Show SMILES Cl.CC(C)(C)c1ccc(OCc2cn(C\C(F)=C\CN)nn2)cc1 Show InChI InChI=1S/C17H23FN4O/c1-17(2,3)13-4-6-16(7-5-13)23-12-15-11-22(21-20-15)10-14(18)8-9-19/h4-8,11H,9-10,12,19H2,1-3H3/b14-8-	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	794	n/a	n/a	n/a	n/a	n/a	n/a
Pharmaxis Ltd Curated by ChEMBL					Assay Description Inhibition of recombinant human C-terminal His-tagged LOLX2 (1-774 residues) expressed in mouse myeloma cells using putrescine as substrate preincuba...				J Med Chem 62: 9874-9889 (2019) Article DOI: 10.1021/acs.jmedchem.9b01283
					More data for this Ligand-Target Pair