BDBM50449404 CHEMBL3127263

SMILES: Oc1ccc(Br)cc1CN1C(N(Cc2cc(Br)ccc2O)c2cc(ccc12)[N+]([O-])=O)c1cc(Br)ccc1O

InChI Key: InChIKey=DRJFKAQEUALKDH-UHFFFAOYSA-N

Data: 3 EC50

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 3 hits for monomerid = 50449404   

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
Presequence protease, mitochondrial (Homo sapiens (Human))	BDBM50449404 (CHEMBL3127263) Show SMILES Oc1ccc(Br)cc1CN1C(N(Cc2cc(Br)ccc2O)c2cc(ccc12)[N+]([O-])=O)c1cc(Br)ccc1O Show InChI InChI=1S/C27H20Br3N3O5/c28-17-1-6-24(34)15(9-17)13-31-22-5-4-20(33(37)38)12-23(22)32(14-16-10-18(29)2-7-25(16)35)27(31)21-11-19(30)3-8-26(21)36/h1-12,27,34-36H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	57	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human PreP assessed as degradation of fluorogenic substrate V measured for 10 mins by fluorometric analysis				Eur J Med Chem 76: 506-16 (2014) Article DOI: 10.1016/j.ejmech.2014.02.046 BindingDB Entry DOI: 10.7270/Q2R78GQ3
					More data for this Ligand-Target Pair
Presequence protease, mitochondrial (Homo sapiens (Human))	BDBM50449404 (CHEMBL3127263) Show SMILES Oc1ccc(Br)cc1CN1C(N(Cc2cc(Br)ccc2O)c2cc(ccc12)[N+]([O-])=O)c1cc(Br)ccc1O Show InChI InChI=1S/C27H20Br3N3O5/c28-17-1-6-24(34)15(9-17)13-31-22-5-4-20(33(37)38)12-23(22)32(14-16-10-18(29)2-7-25(16)35)27(31)21-11-19(30)3-8-26(21)36/h1-12,27,34-36H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	402	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human PreP assessed as degradation of biotin-labeled amyloid beta (1 to 42) after 2.5 hrs by Immunoblotting assay				Eur J Med Chem 76: 506-16 (2014) Article DOI: 10.1016/j.ejmech.2014.02.046 BindingDB Entry DOI: 10.7270/Q2R78GQ3
					More data for this Ligand-Target Pair
Presequence protease, mitochondrial (Homo sapiens (Human))	BDBM50449404 (CHEMBL3127263) Show SMILES Oc1ccc(Br)cc1CN1C(N(Cc2cc(Br)ccc2O)c2cc(ccc12)[N+]([O-])=O)c1cc(Br)ccc1O Show InChI InChI=1S/C27H20Br3N3O5/c28-17-1-6-24(34)15(9-17)13-31-22-5-4-20(33(37)38)12-23(22)32(14-16-10-18(29)2-7-25(16)35)27(31)21-11-19(30)3-8-26(21)36/h1-12,27,34-36H,13-14H2	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	601	n/a	n/a	n/a	n/a
University of Kansas Curated by ChEMBL					Assay Description Agonist activity at human PreP assessed as degradation of ATP synthase pF1beta subunit (2 to 56) after 2.5 hrs by Immunoblotting assay				Eur J Med Chem 76: 506-16 (2014) Article DOI: 10.1016/j.ejmech.2014.02.046 BindingDB Entry DOI: 10.7270/Q2R78GQ3
					More data for this Ligand-Target Pair