BDBM7970 N-diethylcysteamine::diethyl(2-sulfanylethyl)amine

SMILES: CCN(CC)CCS

InChI Key: InChIKey=YBDSNEVSFQMCTL-UHFFFAOYSA-N

Data: 1 KI

PDB links: 447 PDB IDs contain this monomer as substructures. 447 PDB IDs contain inhibitors having a similarity of 90% to this monomer.

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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 = 7970   

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
Glutaminyl Cyclase (Mus musculus (mouse))	BDBM7970 (N-diethylcysteamine | diethyl(2-sulfanylethyl)amin...) Show SMILES CCN(CC)CCS Show InChI InChI=1S/C6H15NS/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	1.09E+4	-6.88	n/a	n/a	n/a	n/a	n/a	8.0	30
Probiodrug AG					Assay Description QC activity was evaluated fluorometrically using Gln-AMC as substrate, and pyroglutamyl peptidase as the auxiliary enzyme. After conversion of Gln-AM...				Biochemistry 44: 13415-24 (2005) Article DOI: 10.1021/bi051142e BindingDB Entry DOI: 10.7270/Q21834QW
					More data for this Ligand-Target Pair