Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 220.3 BDBM50049766

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM50049766 (1-Phenyl-1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naph...) Show SMILES C1Cc2ccccc2C2C1C2c1ccccc1 Show InChI InChI=1S/C17H16/c1-2-7-13(8-3-1)16-15-11-10-12-6-4-5-9-14(12)17(15)16/h1-9,15-17H,10-11H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universität de Saarlandes Curated by ChEMBL					Assay Description Inhibitory activity against Steroidgenic Cytochrome P450 C18 using Bovine adrenal mitochondria.				J Med Chem 39: 834-41 (1996) Article DOI: 10.1021/jm950377t BindingDB Entry DOI: 10.7270/Q29K499J
					More data for this Ligand-Target Pair
Aromatase (Homo sapiens (Human))	BDBM50049766 (1-Phenyl-1a,2,3,7b-tetrahydro-1H-cyclopropa[a]naph...) Show SMILES C1Cc2ccccc2C2C1C2c1ccccc1 Show InChI InChI=1S/C17H16/c1-2-7-13(8-3-1)16-15-11-10-12-6-4-5-9-14(12)17(15)16/h1-9,15-17H,10-11H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universität de Saarlandes Curated by ChEMBL					Assay Description In vitro inhibitory activity against Cytochrome P450 19A1 using human placental microsomes.				J Med Chem 39: 834-41 (1996) Article DOI: 10.1021/jm950377t BindingDB Entry DOI: 10.7270/Q29K499J
					More data for this Ligand-Target Pair