BDBM50086407 CHEMBL3426083

SMILES: CS(=O)(=O)c1cccc(Nc2ncnc3ccc(cc23)-c2cncs2)c1

InChI Key: InChIKey=XMZBWFLDXDKJSK-UHFFFAOYSA-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 = 50086407   

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
Lymphocyte differentiation antigen CD38 (Homo sapiens (Human))	BDBM50086407 (CHEMBL3426083) Show SMILES CS(=O)(=O)c1cccc(Nc2ncnc3ccc(cc23)-c2cncs2)c1 Show InChI InChI=1S/C18H14N4O2S2/c1-26(23,24)14-4-2-3-13(8-14)22-18-15-7-12(17-9-19-11-25-17)5-6-16(15)20-10-21-18/h2-11H,1H3,(H,20,21,22)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.69E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of human CD38 extracellular domain expressed in Pichia pastoris assessed as NAD hydrolysis by colorimetric-based assay				J Med Chem 58: 3548-71 (2015) Article DOI: 10.1021/jm502009h BindingDB Entry DOI: 10.7270/Q2NV9M00
					More data for this Ligand-Target Pair
ADP-ribosyl cyclase/cyclic ADP-ribose hydrolase 1 (Mus musculus)	BDBM50086407 (CHEMBL3426083) Show SMILES CS(=O)(=O)c1cccc(Nc2ncnc3ccc(cc23)-c2cncs2)c1 Show InChI InChI=1S/C18H14N4O2S2/c1-26(23,24)14-4-2-3-13(8-14)22-18-15-7-12(17-9-19-11-25-17)5-6-16(15)20-10-21-18/h2-11H,1H3,(H,20,21,22)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of mouse recombinant CD38 extracellular domain expressed in CHO CGE cells assessed as NAD hydrolysis by fluorescence plate reader analysis				J Med Chem 58: 3548-71 (2015) Article DOI: 10.1021/jm502009h BindingDB Entry DOI: 10.7270/Q2NV9M00
					More data for this Ligand-Target Pair