BDBM39863 2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)ethanamide::2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl]sulfanyl-1,2-thiazol-5-yl]sulfanyl]-N-(4-methyl-1,3-thiazol-2-yl)acetamide::2-[[4-cyano-3-[[2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl]thio]-5-isothiazolyl]thio]-N-(4-methyl-2-thiazolyl)acetamide::2-[[4-cyano-3-[[2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl]thio]isothiazol-5-yl]thio]-N-(4-methylthiazol-2-yl)acetamide::MLS000069333::SMR000036191::cid_658035

SMILES Cc1csc(NC(=O)CSc2nsc(SCC(=O)Nc3nc(C)cs3)c2C#N)n1

InChI Key InChIKey=LHPLNHDJOIBQPV-UHFFFAOYSA-N

Data  1 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 39863   

TargetIntegrin alpha-4(Homo sapiens (Human))
Nmmlsc

Curated by PubChem BioAssay
LigandPNGBDBM39863(2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino...)
Affinity DataEC50:  2.02E+4nMAssay Description:Assay Support: 1 X01 MH077638-01 MLSCN Assay for Allosteric Ligands for the VLA-4 Integrin PI: SKLAR, LARRY A University of New Mexico Assay Overview...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay
Target14-3-3 protein gamma(Homo sapiens (Human))
Emory University

Curated by PubChem BioAssay
LigandPNGBDBM39863(2-[[4-cyano-3-[2-[(4-methyl-1,3-thiazol-2-yl)amino...)
Affinity DataIC50: >5.00E+4nMAssay Description:NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN MLSCN Grant: 1 X01MH78953-01 The 14-3-3 pr...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay