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SMILES: Nc1nc2nc(cnc2c(=O)[nH]1)C(=O)NCCc1cccs1

InChI Key: InChIKey=QUMXUWOZWVBTLE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50420403   
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
Ricin


(Ricinus communis)		BDBM50420403
PNG
(CHEMBL2089309)
Show SMILES Nc1nc2nc(cnc2c(=O)[nH]1)C(=O)NCCc1cccs1
Show InChI InChI=1S/C13H12N6O2S/c14-13-18-10-9(12(21)19-13)16-6-8(17-10)11(20)15-4-3-7-2-1-5-22-7/h1-2,5-6H,3-4H2,(H,15,20)(H3,14,17,18,19,21)
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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.80E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of Ricinus communis ricin toxin A after 90 mins by luciferase reporter gene assay

ACS Med Chem Lett 3: 588-591 (2012)


Article DOI: 10.1021/ml300099t
BindingDB Entry DOI: 10.7270/Q2N29Z7B
More data for this
Ligand-Target Pair