BDBM50245305 CHEMBL4097027

SMILES: CNS(=O)(=O)c1cccc(Nc2cc(Nc3cccc(C)c3)ncn2)c1

InChI Key: InChIKey=WJHKUMPTDFBBGR-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 = 50245305   

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
TNNI3K (Homo sapiens (Human))	BDBM50245305 (CHEMBL4097027) Show SMILES CNS(=O)(=O)c1cccc(Nc2cc(Nc3cccc(C)c3)ncn2)c1 Show InChI InChI=1S/C18H19N5O2S/c1-13-5-3-6-14(9-13)22-17-11-18(21-12-20-17)23-15-7-4-8-16(10-15)26(24,25)19-2/h3-12,19H,1-2H3,(H2,20,21,22,23)	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of NEP 24.11 from rat kidney				J Med Chem 61: 3076-3088 (2018) Article DOI: 10.1021/acs.jmedchem.8b00125 BindingDB Entry DOI: 10.7270/Q2Z3221C
					More data for this Ligand-Target Pair
Epidermal growth factor receptor (Homo sapiens (Human))	BDBM50245305 (CHEMBL4097027) Show SMILES CNS(=O)(=O)c1cccc(Nc2cc(Nc3cccc(C)c3)ncn2)c1 Show InChI InChI=1S/C18H19N5O2S/c1-13-5-3-6-14(9-13)22-17-11-18(21-12-20-17)23-15-7-4-8-16(10-15)26(24,25)19-2/h3-12,19H,1-2H3,(H2,20,21,22,23)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of EGFR (unknown origin)				J Med Chem 61: 3076-3088 (2018) Article DOI: 10.1021/acs.jmedchem.8b00125 BindingDB Entry DOI: 10.7270/Q2Z3221C
					More data for this Ligand-Target Pair