BDBM50249104 CHEMBL4089210

SMILES: COC(=O)c1cccc2n(ncc12)-c1cncc(c1)C(C)(C)O

InChI Key: InChIKey=PKLUUQCHFDVAHE-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 50249104   

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 11B2 (Homo sapiens (Human))	BDBM50249104 (CHEMBL4089210) Show SMILES COC(=O)c1cccc2n(ncc12)-c1cncc(c1)C(C)(C)O Show InChI InChI=1S/C17H17N3O3/c1-17(2,22)11-7-12(9-18-8-11)20-15-6-4-5-13(16(21)23-3)14(15)10-19-20/h4-10,22H,1-3H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human CYP11B2-CLE9 expressed in Chinese hamster V79 cells using 11-deoxycorticosterone as substrate preincubated for 1 hr followed by s...				Bioorg Med Chem Lett 27: 2384-2388 (2017) Article DOI: 10.1016/j.bmcl.2017.04.021 BindingDB Entry DOI: 10.7270/Q2MC92F2
					More data for this Ligand-Target Pair