BDBM50238968 CHEMBL4078738

SMILES: CCN(CC)CCCn1c2ccccc2c(=O)c2cc(C)cc(C)c12

InChI Key: InChIKey=DJTKQWPRLIGMKH-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 = 50238968   

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
Multidrug resistance protein 1/Multidrug resistance associated protein 1 (Homo sapiens (Human))	BDBM50238968 (CHEMBL4078738) Show SMILES CCN(CC)CCCn1c2ccccc2c(=O)c2cc(C)cc(C)c12 Show InChI InChI=1S/C22H28N2O/c1-5-23(6-2)12-9-13-24-20-11-8-7-10-18(20)22(25)19-15-16(3)14-17(4)21(19)24/h7-8,10-11,14-15H,5-6,9,12-13H2,1-4H3	PDB UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
SVKM's Dr. Bhanuben Nanavati College of Pharmacy Curated by ChEMBL					Assay Description In vitro inhibitory activity against human plasma renin				Eur J Med Chem 130: 154-170 (2017) Article DOI: 10.1016/j.ejmech.2017.02.022 BindingDB Entry DOI: 10.7270/Q26D5W99
					More data for this Ligand-Target Pair