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SMILES: COC(=O)CSc1nc(ccc1C#N)-c1cccs1

InChI Key: InChIKey=MDESTVZURZNPFN-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 49195   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Transcription factor p65


(Homo sapiens (Human))		BDBM49195
PNG
(2-[(3-cyano-6-thiophen-2-yl-2-pyridinyl)thio]aceti...)
Show SMILES COC(=O)CSc1nc(ccc1C#N)-c1cccs1
Show InChI InChI=1S/C13H10N2O2S2/c1-17-12(16)8-19-13-9(7-14)4-5-10(15-13)11-3-2-6-18-11/h2-6H,8H2,1H3
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KEGG

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PC cid
PC sid
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Similars
PCBioAssay
n/an/an/an/a 5.62E+3n/an/an/an/a



SRMLSC

Curated by PubChem BioAssay


Assay Description
Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...

PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q27P8WT7
More data for this
Ligand-Target Pair