BDBM50239811 CHEMBL4078318

SMILES: Cc1cncc(Cc2ccc(nc2)-c2ccoc2)c1

InChI Key: InChIKey=XVBAAEZLMRHWDY-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50239811   

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, mitochondrial (Homo sapiens (Human))	BDBM50239811 (CHEMBL4078318) Show SMILES Cc1cncc(Cc2ccc(nc2)-c2ccoc2)c1 Show InChI InChI=1S/C16H14N2O/c1-12-6-14(9-17-8-12)7-13-2-3-16(18-10-13)15-4-5-19-11-15/h2-6,8-11H,7H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
Saarland University Curated by ChEMBL					Assay Description The compound was tested for the ability to displace opioid receptor delta specific radioligand [3H]-DSLET				J Med Chem 60: 5086-5098 (2017) Article DOI: 10.1021/acs.jmedchem.7b00437 BindingDB Entry DOI: 10.7270/Q24F1SWW
					More data for this Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial (Homo sapiens (Human))	BDBM50239811 (CHEMBL4078318) Show SMILES Cc1cncc(Cc2ccc(nc2)-c2ccoc2)c1 Show InChI InChI=1S/C16H14N2O/c1-12-6-14(9-17-8-12)7-13-2-3-16(18-10-13)15-4-5-19-11-15/h2-6,8-11H,7H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Saarland University Curated by ChEMBL					Assay Description Inhibition of human CYP11B1 expressed in hamster V79MZ cells using [1,2-3H]-11-deoxycorticosterone as substrate after 6 hrs by HPLC analysis				J Med Chem 60: 5086-5098 (2017) Article DOI: 10.1021/acs.jmedchem.7b00437 BindingDB Entry DOI: 10.7270/Q24F1SWW
					More data for this Ligand-Target Pair