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BDBM65375 MLS000688659::N-[(2-cyanoethanoylamino)carbamothioyl]-4-methyl-benzamide::N-[[(2-cyano-1-oxoethyl)hydrazo]-sulfanylidenemethyl]-4-methylbenzamide::N-[[(2-cyanoacetyl)amino]carbamothioyl]-4-methylbenzamide::N-[[(2-cyanoacetyl)amino]thiocarbamoyl]-4-methyl-benzamide::SMR000284538::cid_1728285

SMILES: Cc1ccc(cc1)C(=O)NC(=S)NNC(=O)CC#N

InChI Key: InChIKey=LRIQZFOZSQNHBX-UHFFFAOYSA-N

Data: 1 EC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 65375   
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
MSRA protein


(Bos taurus)		BDBM65375
PNG
(MLS000688659 | N-[(2-cyanoethanoylamino)carbamothi...)
Show SMILES Cc1ccc(cc1)C(=O)NC(=S)NNC(=O)CC#N
Show InChI InChI=1S/C12H12N4O2S/c1-8-2-4-9(5-3-8)11(18)14-12(19)16-15-10(17)6-7-13/h2-5H,6H2,1H3,(H,15,17)(H2,14,16,18,19)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/an/an/a>1.04E+5n/an/an/an/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/Q2BZ64NT
More data for this
Ligand-Target Pair