BDBM87398 MLS000094341::N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[3-(1-methyl-1,2,3,6-tetrahydropyridin-4-yl)-1,2,4-oxadiazol-5-yl]propanamide::N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-oxadiazol-5-yl]propanamide::N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3-[3-(1-methyl-3,6-dihydro-2H-pyridin-4-yl)-1,2,4-oxadiazol-5-yl]propionamide::SMR000029931::cid_3238746

SMILES: CCc1nnc(NC(=O)CCc2nc(no2)C2=CCN(C)CC2)s1

InChI Key: InChIKey=XQSYZRLTPFPORF-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 = 87398   

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
Tyrosine-protein kinase ABL1 (Homo sapiens (Human))	BDBM87398 (MLS000094341 | N-(5-ethyl-1,3,4-thiadiazol-2-yl)-3...) Show SMILES CCc1nnc(NC(=O)CCc2nc(no2)C2=CCN(C)CC2)s1 |t:17| Show InChI InChI=1S/C15H20N6O2S/c1-3-13-18-19-15(24-13)16-11(22)4-5-12-17-14(20-23-12)10-6-8-21(2)9-7-10/h6H,3-5,7-9H2,1-2H3,(H,16,19,22)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.81E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...				PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2RB736G
					More data for this Ligand-Target Pair