BDBM249213 US9458135, 1

SMILES: CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cccc(Cl)n2)c1

InChI Key: InChIKey=JUKIJSXDHAPPCI-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 249213   

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
Cytochrome P450 11B1, mitochondrial (Homo sapiens (Human))	BDBM249213 (US9458135, 1) Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cccc(Cl)n2)c1 Show InChI InChI=1S/C21H18ClN3O2/c1-25-18-7-5-15(10-16(18)6-8-21(25)26)17-9-14(11-23-12-17)13-27-20-4-2-3-19(22)24-20/h2-5,7,9-12H,6,8,13H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	9.10	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Herein we identified the use of the G-402 cell line as a host cell to ectopically express (transiently or stably) enzymes of the CYP11 family. Specif...				US Patent US9458135 (2016) BindingDB Entry DOI: 10.7270/Q2KW5F04
					More data for this Ligand-Target Pair
Cytochrome P450 11B2 (CYP11B2) (Homo sapiens (Human))	BDBM249213 (US9458135, 1) Show SMILES CN1C(=O)CCc2cc(ccc12)-c1cncc(COc2cccc(Cl)n2)c1 Show InChI InChI=1S/C21H18ClN3O2/c1-25-18-7-5-15(10-16(18)6-8-21(25)26)17-9-14(11-23-12-17)13-27-20-4-2-3-19(22)24-20/h2-5,7,9-12H,6,8,13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.200	n/a	n/a	n/a	n/a
Hoffmann-La Roche Inc. US Patent					Assay Description Herein we identified the use of the G-402 cell line as a host cell to ectopically express (transiently or stably) enzymes of the CYP11 family. Specif...				US Patent US9458135 (2016) BindingDB Entry DOI: 10.7270/Q2KW5F04
					More data for this Ligand-Target Pair