BDBM50355598 CHEMBL1910752

SMILES: NC(=N)N\N=C\c1c(nc2sccn12)-c1cccc(c1)[N+]([O-])=O

InChI Key: InChIKey=UDQKLBNAKBHTTN-FRKPEAEDSA-N

Data: 3 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 3 hits for monomerid = 50355598   

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
Serine/threonine-protein kinase Chk1 (Homo sapiens (Human))	BDBM50355598 (CHEMBL1910752) Show SMILES NC(=N)N\N=C\c1c(nc2sccn12)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H11N7O2S/c14-12(15)18-16-7-10-11(17-13-19(10)4-5-23-13)8-2-1-3-9(6-8)20(21)22/h1-7H,(H4,14,15,18)/b16-7+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Bologna Curated by ChEMBL					Assay Description Inhibition of CHK1 assessed as inhibition of substrate phosphorylation using fluorescent peptide substrate by microplate reader assay				Eur J Med Chem 46: 4311-23 (2011) Article DOI: 10.1016/j.ejmech.2011.07.001 BindingDB Entry DOI: 10.7270/Q2NG4R1D
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase CHK2 (Homo sapiens (Human))	BDBM50355598 (CHEMBL1910752) Show SMILES NC(=N)N\N=C\c1c(nc2sccn12)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H11N7O2S/c14-12(15)18-16-7-10-11(17-13-19(10)4-5-23-13)8-2-1-3-9(6-8)20(21)22/h1-7H,(H4,14,15,18)/b16-7+	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Bologna Curated by ChEMBL					Assay Description Inhibition of CHK2 assessed as inhibition of substrate phosphorylation using fluorescent peptide substrate by microplate reader assay				Eur J Med Chem 46: 4311-23 (2011) Article DOI: 10.1016/j.ejmech.2011.07.001 BindingDB Entry DOI: 10.7270/Q2NG4R1D
					More data for this Ligand-Target Pair
Ribosomal protein S6 kinase alpha-3 (Homo sapiens (Human))	BDBM50355598 (CHEMBL1910752) Show SMILES NC(=N)N\N=C\c1c(nc2sccn12)-c1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C13H11N7O2S/c14-12(15)18-16-7-10-11(17-13-19(10)4-5-23-13)8-2-1-3-9(6-8)20(21)22/h1-7H,(H4,14,15,18)/b16-7+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.85E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ di Bologna Curated by ChEMBL					Assay Description Inhibition of RSK2 assessed as inhibition of substrate phosphorylation using fluorescent peptide substrate by microplate reader assay				Eur J Med Chem 46: 4311-23 (2011) Article DOI: 10.1016/j.ejmech.2011.07.001 BindingDB Entry DOI: 10.7270/Q2NG4R1D
					More data for this Ligand-Target Pair