BDBM50079989 CHEMBL3415253

SMILES: Clc1ccc2sc(SCCCCCn3ccnc3)nc2c1

InChI Key: InChIKey=ISHOSZWXUJZMLH-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50079989   

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
Heme Oxygenase 2 (HO-2) (Rattus norvegicus (rat))	BDBM50079989 (CHEMBL3415253) Show SMILES Clc1ccc2sc(SCCCCCn3ccnc3)nc2c1 Show InChI InChI=1S/C15H16ClN3S2/c16-12-4-5-14-13(10-12)18-15(21-14)20-9-3-1-2-7-19-8-6-17-11-19/h4-6,8,10-11H,1-3,7,9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Inhibition of HO2 in Sprague-Dawley rat brain microsomal fraction assessed as reduction in bilirubin formation incubated for 60 mins by double beam s...				Eur J Med Chem 96: 162-72 (2015) Article DOI: 10.1016/j.ejmech.2015.04.003 BindingDB Entry DOI: 10.7270/Q2KH0Q16
					More data for this Ligand-Target Pair
Heme Oxygenase 1 (HO-1) (Rattus norvegicus (rat))	BDBM50079989 (CHEMBL3415253) Show SMILES Clc1ccc2sc(SCCCCCn3ccnc3)nc2c1 Show InChI InChI=1S/C15H16ClN3S2/c16-12-4-5-14-13(10-12)18-15(21-14)20-9-3-1-2-7-19-8-6-17-11-19/h4-6,8,10-11H,1-3,7,9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Inhibition of HO-1 in Sprague-Dawley albino rat spleen microsomes assessed as reduction in bilirubin formation using hemin as substrate after 60 mins...				Eur J Med Chem 148: 54-62 (2018) Article DOI: 10.1016/j.ejmech.2018.02.007 BindingDB Entry DOI: 10.7270/Q28P633V
					More data for this Ligand-Target Pair
Heme Oxygenase 2 (HO-2) (Rattus norvegicus (rat))	BDBM50079989 (CHEMBL3415253) Show SMILES Clc1ccc2sc(SCCCCCn3ccnc3)nc2c1 Show InChI InChI=1S/C15H16ClN3S2/c16-12-4-5-14-13(10-12)18-15(21-14)20-9-3-1-2-7-19-8-6-17-11-19/h4-6,8,10-11H,1-3,7,9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Inhibition of HO-2 in Sprague-Dawley albino rat brain microsomes assessed as reduction in bilirubin formation using hemin as substrate after 60 mins ...				Eur J Med Chem 148: 54-62 (2018) Article DOI: 10.1016/j.ejmech.2018.02.007 BindingDB Entry DOI: 10.7270/Q28P633V
					More data for this Ligand-Target Pair
Heme Oxygenase 1 (HO-1) (Rattus norvegicus (rat))	BDBM50079989 (CHEMBL3415253) Show SMILES Clc1ccc2sc(SCCCCCn3ccnc3)nc2c1 Show InChI InChI=1S/C15H16ClN3S2/c16-12-4-5-14-13(10-12)18-15(21-14)20-9-3-1-2-7-19-8-6-17-11-19/h4-6,8,10-11H,1-3,7,9H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Catania Curated by ChEMBL					Assay Description Inhibition of HO1 in Sprague-Dawley rat spleen microsomal fraction assessed as reduction in bilirubin formation incubated for 60 mins by double beam ...				Eur J Med Chem 96: 162-72 (2015) Article DOI: 10.1016/j.ejmech.2015.04.003 BindingDB Entry DOI: 10.7270/Q2KH0Q16
					More data for this Ligand-Target Pair