BDBM50207098 4-(4-(1H-imidazol-1-yl)phenoxy)-2-(benzo[d][1,3]dioxol-5-ylmethyl)-6-morpholinopyrimidine::CHEMBL244397

SMILES: C(c1ccc2OCOc2c1)c1nc(Oc2ccc(cc2)-n2ccnc2)cc(n1)N1CCOCC1

InChI Key: InChIKey=WGFLIJQCXCLGRO-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 = 50207098   

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
Nitric oxide synthase, inducible (Homo sapiens (Human))	BDBM50207098 (4-(4-(1H-imidazol-1-yl)phenoxy)-2-(benzo[d][1,3]di...) Show SMILES C(c1ccc2OCOc2c1)c1nc(Oc2ccc(cc2)-n2ccnc2)cc(n1)N1CCOCC1 Show InChI InChI=1S/C25H23N5O4/c1-6-21-22(33-17-32-21)13-18(1)14-23-27-24(29-9-11-31-12-10-29)15-25(28-23)34-20-4-2-19(3-5-20)30-8-7-26-16-30/h1-8,13,15-16H,9-12,14,17H2	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	830	n/a	n/a	n/a	n/a	n/a	n/a
Berlex Biosciences Curated by ChEMBL					Assay Description Inhibition of iNOS in human A172 cells after 18 to 24 hrs				Bioorg Med Chem Lett 17: 2505-8 (2007) Article DOI: 10.1016/j.bmcl.2007.02.018 BindingDB Entry DOI: 10.7270/Q2XG9QTP
					More data for this Ligand-Target Pair