BDBM50062260 CHEMBL38403::[3-(2-Chloro-phenothiazin-10-yl)-propyl]-propyl-diazene

SMILES: CCCN=NCCCN1c2ccccc2Sc2ccc(Cl)cc12

InChI Key: InChIKey=PJUBEHCJUMFFBQ-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50062260   

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
Trypanothione reductase (Trypanosoma cruzi)	BDBM50062260 (CHEMBL38403 | [3-(2-Chloro-phenothiazin-10-yl)-pro...) Show SMILES CCCN=NCCCN1c2ccccc2Sc2ccc(Cl)cc12 |w:3.2| Show InChI InChI=1S/C18H20ClN3S/c1-2-10-20-21-11-5-12-22-15-6-3-4-7-17(15)23-18-9-8-14(19)13-16(18)22/h3-4,6-9,13H,2,5,10-12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.87E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory activity against recombinant Trypanosoma cruzi (T. cruzi) Trypanothione reductase (linear competitive type)				J Med Chem 41: 148-56 (1998) Article DOI: 10.1021/jm960814j BindingDB Entry DOI: 10.7270/Q2ZP457X
					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma cruzi)	BDBM50062260 (CHEMBL38403 | [3-(2-Chloro-phenothiazin-10-yl)-pro...) Show SMILES CCCN=NCCCN1c2ccccc2Sc2ccc(Cl)cc12 |w:3.2| Show InChI InChI=1S/C18H20ClN3S/c1-2-10-20-21-11-5-12-22-15-6-3-4-7-17(15)23-18-9-8-14(19)13-16(18)22/h3-4,6-9,13H,2,5,10-12H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.55E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Manchester Curated by ChEMBL					Assay Description Inhibitory activity against recombinant Trypanosoma cruzi (Trypanosoma cruzi) Trypanothione reductase				J Med Chem 41: 148-56 (1998) Article DOI: 10.1021/jm960814j BindingDB Entry DOI: 10.7270/Q2ZP457X
					More data for this Ligand-Target Pair