BDBM50218358 CHEMBL238789::N1-[4-methyl-5-(5H-[1,2,4]triazolo[3',4':2,3][1,3,4]-thiadiazino[5,6-b]quinoxalin-3-yl)-2-thienyl]-acetamide

SMILES: CC(=O)Nc1cc(C)c(s1)-c1nnc2Sc3nc4ccccc4nc3Nn12

InChI Key: InChIKey=LNGGMJFRIWMXLS-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 = 50218358   

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
Cyclin-dependent kinase 5 activator 1 (Homo sapiens (Human))	BDBM50218358 (CHEMBL238789 | N1-[4-methyl-5-(5H-[1,2,4]triazolo[...) Show SMILES CC(=O)Nc1cc(C)c(s1)-c1nnc2Sc3nc4ccccc4nc3Nn12 Show InChI InChI=1S/C17H13N7OS2/c1-8-7-12(18-9(2)25)26-13(8)15-21-22-17-24(15)23-14-16(27-17)20-11-6-4-3-5-10(11)19-14/h3-7H,1-2H3,(H,18,25)(H,19,23)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
Dr. Reddy's Laboratories Curated by ChEMBL					Assay Description Inhibitory activity against Cdk5/p25				Bioorg Med Chem 15: 6397-406 (2007) Article DOI: 10.1016/j.bmc.2007.06.053 BindingDB Entry DOI: 10.7270/Q2JS9RP0
					More data for this Ligand-Target Pair